1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane

C268H372N28O38 — CID 158877195

IUPAC1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane
SMILESC/C=C/COc1cc(C)c(OCCCOc2ccc(C=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCCOc2ccc(C=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccnc(C(C)=NOC)c2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccnc(C=NOC)c2)c(C)c1.C/C=C/COc1cc(C)c(OCc2cncc(C(C)=NOC)c2)c(C)c1.C/C=C/COc1cc(C)c(OCc2cncc(C=NOC)c2)c(C)c1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC
InChIInChI=1S/C21H27N3O4.4C21H26N2O3.C20H25N3O4.C20H25N3O3.4C20H24N2O3.C19H23N3O3.12C2H6/c1-5-6-10-26-19-13-16(2)21(17(3)14-19)28-12-7-11-27-20-9-8-18(23-24-20)15-22-25-4;1-6-7-10-25-20-11-15(2)21(16(3)12-20)26-14-19-9-8-18(13-22-19)17(4)23-24-5;1-6-7-10-25-19-11-15(2)21(16(3)12-19)26-14-18-8-9-22-20(13-18)17(4)23-24-5;1-6-7-10-25-19-11-15(2)21(16(3)12-19)26-14-18-8-9-20(22-13-18)17(4)23-24-5;1-6-7-8-25-20-9-15(2)21(16(3)10-20)26-14-18-11-19(13-22-12-18)17(4)23-24-5;1-5-6-9-25-18-12-15(2)20(16(3)13-18)27-11-10-26-19-8-7-17(22-23-19)14-21-24-4;1-6-7-10-25-18-11-14(2)20(15(3)12-18)26-13-17-8-9-19(22-21-17)16(4)23-24-5;1-5-6-9-24-19-10-15(2)20(16(3)11-19)25-14-17-7-8-21-18(12-17)13-22-23-4;1-5-6-9-24-19-10-15(2)20(16(3)11-19)25-14-17-7-8-18(21-12-17)13-22-23-4;1-5-6-9-24-19-10-15(2)20(16(3)11-19)25-14-18-8-7-17(12-21-18)13-22-23-4;1-5-6-7-24-19-8-15(2)20(16(3)9-19)25-14-18-10-17(11-21-12-18)13-22-23-4;1-5-6-9-24-18-10-14(2)19(15(3)11-18)25-13-17-8-7-16(21-22-17)12-20-23-4;12*1-2/h5-6,8-9,13-15H,7,10-12H2,1-4H3;3*6-9,11-13H,10,14H2,1-5H3;6-7,9-13H,8,14H2,1-5H3;5-8,12-14H,9-11H2,1-4H3;6-9,11-12H,10,13H2,1-5H3;3*5-8,10-13H,9,14H2,1-4H3;5-6,8-13H,7,14H2,1-4H3;5-8,10-12H,9,13H2,1-4H3;12*1-2H3/b6-5+,22-15?;4*7-6+,23-17?;6-5+,21-14?;7-6+,23-16?;4*6-5+,22-13?;6-5+,20-12?;;;;;;;;;;;;
InChIKeyJCOWGGUQDPSGSK-JPYSDVJPSA-N
MW4594.08 g/mol
LogP62.54
Rot. Bonds101

About 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane

1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane (PubChem CID 158877195) has the molecular formula C268H372N28O38 and a molecular weight of 4594.08 g/mol. Its IUPAC name is 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane.

Molecular Properties

Compound Name1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane
PubChem CID158877195
Molecular FormulaC268H372N28O38
Molecular Weight4594.08 g/mol
Exact Mass4590.80
IUPAC Name1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane
SMILESC/C=C/COc1cc(C)c(OCCCOc2ccc(C=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCCOc2ccc(C=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccnc(C(C)=NOC)c2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccnc(C=NOC)c2)c(C)c1.C/C=C/COc1cc(C)c(OCc2cncc(C(C)=NOC)c2)c(C)c1.C/C=C/COc1cc(C)c(OCc2cncc(C=NOC)c2)c(C)c1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC
InChIInChI=1S/C21H27N3O4.4C21H26N2O3.C20H25N3O4.C20H25N3O3.4C20H24N2O3.C19H23N3O3.12C2H6/c1-5-6-10-26-19-13-16(2)21(17(3)14-19)28-12-7-11-27-20-9-8-18(23-24-20)15-22-25-4;1-6-7-10-25-20-11-15(2)21(16(3)12-20)26-14-19-9-8-18(13-22-19)17(4)23-24-5;1-6-7-10-25-19-11-15(2)21(16(3)12-19)26-14-18-8-9-22-20(13-18)17(4)23-24-5;1-6-7-10-25-19-11-15(2)21(16(3)12-19)26-14-18-8-9-20(22-13-18)17(4)23-24-5;1-6-7-8-25-20-9-15(2)21(16(3)10-20)26-14-18-11-19(13-22-12-18)17(4)23-24-5;1-5-6-9-25-18-12-15(2)20(16(3)13-18)27-11-10-26-19-8-7-17(22-23-19)14-21-24-4;1-6-7-10-25-18-11-14(2)20(15(3)12-18)26-13-17-8-9-19(22-21-17)16(4)23-24-5;1-5-6-9-24-19-10-15(2)20(16(3)11-19)25-14-17-7-8-21-18(12-17)13-22-23-4;1-5-6-9-24-19-10-15(2)20(16(3)11-19)25-14-17-7-8-18(21-12-17)13-22-23-4;1-5-6-9-24-19-10-15(2)20(16(3)11-19)25-14-18-8-7-17(12-21-18)13-22-23-4;1-5-6-7-24-19-8-15(2)20(16(3)9-19)25-14-18-10-17(11-21-12-18)13-22-23-4;1-5-6-9-24-18-10-14(2)19(15(3)11-18)25-13-17-8-7-16(21-22-17)12-20-23-4;12*1-2/h5-6,8-9,13-15H,7,10-12H2,1-4H3;3*6-9,11-13H,10,14H2,1-5H3;6-7,9-13H,8,14H2,1-5H3;5-8,12-14H,9-11H2,1-4H3;6-9,11-12H,10,13H2,1-5H3;3*5-8,10-13H,9,14H2,1-4H3;5-6,8-13H,7,14H2,1-4H3;5-8,10-12H,9,13H2,1-4H3;12*1-2H3/b6-5+,22-15?;4*7-6+,23-17?;6-5+,21-14?;7-6+,23-16?;4*6-5+,22-13?;6-5+,20-12?;;;;;;;;;;;;
InChIKeyJCOWGGUQDPSGSK-JPYSDVJPSA-N
XLogP62.54
TPSA705.30 Ų
H-Bond Donors
H-Bond Acceptors66
Rotatable Bonds101
Heavy Atoms334
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004594.08
LogP ≤ 562.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1066

Analyze 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane?
The IUPAC name of 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane (CID 158877195) is 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane.
What is the SMILES notation for 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane?
The canonical SMILES for 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane is C/C=C/COc1cc(C)c(OCCCOc2ccc(C=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCCOc2ccc(C=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C=NOC)nn2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccnc(C(C)=NOC)c2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccnc(C=NOC)c2)c(C)c1.C/C=C/COc1cc(C)c(OCc2cncc(C(C)=NOC)c2)c(C)c1.C/C=C/COc1cc(C)c(OCc2cncc(C=NOC)c2)c(C)c1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.
What is the InChIKey of 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane?
The InChIKey is JCOWGGUQDPSGSK-JPYSDVJPSA-N. The full InChI is InChI=1S/C21H27N3O4.4C21H26N2O3.C20H25N3O4.C20H25N3O3.4C20H24N2O3.C19H23N3O3.12C2H6/c1-5-6-10-26-19-13-16(2)21(17(3)14-19)28-12-7-11-27-20-9-8-18(23-24-20)15-22-25-4;1-6-7-10-25-20-11-15(2)21(16(3)12-20)26-14-19-9-8-18(13-22-19)17(4)23-24-5;1-6-7-10-25-19-11-15(2)21(16(3)12-19)26-14-18-8-9-22-20(13-18)17(4)23-24-5;1-6-7-10-25-19-11-15(2)21(16(3)12-19)26-14-18-8-9-20(22-13-18)17(4)23-24-5;1-6-7-8-25-20-9-15(2)21(16(3)10-20)26-14-18-11-19(13-22-12-18)17(4)23-24-5;1-5-6-9-25-18-12-15(2)20(16(3)13-18)27-11-10-26-19-8-7-17(22-23-19)14-21-24-4;1-6-7-10-25-18-11-14(2)20(15(3)12-18)26-13-17-8-9-19(22-21-17)16(4)23-24-5;1-5-6-9-24-19-10-15(2)20(16(3)11-19)25-14-17-7-8-21-18(12-17)13-22-23-4;1-5-6-9-24-19-10-15(2)20(16(3)11-19)25-14-17-7-8-18(21-12-17)13-22-23-4;1-5-6-9-24-19-10-15(2)20(16(3)11-19)25-14-18-8-7-17(12-21-18)13-22-23-4;1-5-6-7-24-19-8-15(2)20(16(3)9-19)25-14-18-10-17(11-21-12-18)13-22-23-4;1-5-6-9-24-18-10-14(2)19(15(3)11-18)25-13-17-8-7-16(21-22-17)12-20-23-4;12*1-2/h5-6,8-9,13-15H,7,10-12H2,1-4H3;3*6-9,11-13H,10,14H2,1-5H3;6-7,9-13H,8,14H2,1-5H3;5-8,12-14H,9-11H2,1-4H3;6-9,11-12H,10,13H2,1-5H3;3*5-8,10-13H,9,14H2,1-4H3;5-6,8-13H,7,14H2,1-4H3;5-8,10-12H,9,13H2,1-4H3;12*1-2H3/b6-5+,22-15?;4*7-6+,23-17?;6-5+,21-14?;7-6+,23-16?;4*6-5+,22-13?;6-5+,20-12?;;;;;;;;;;;;.
What are the key properties of 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane?
1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane has a molecular weight of 4594.08 g/mol, XLogP of 62.54, 101 rotatable bonds, 0 hydrogen bond donors, and 66 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethoxy]pyridazin-3-yl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]pyridazin-3-yl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxyethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine;1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propoxy]pyridazin-3-yl]-N-methoxymethanimine;ethane is sourced from PubChem (CID 158877195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).