1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane

C276H398N22O33 — CID 160608102

IUPAC1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane
SMILESC/C=C/COc1cc(C)c(OCCCCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCc2ccc(C(C)=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCc2ccc(C(C)=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCc2ccc(C=NOC)cn2)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=NOC)cn2)c(C)c1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC
InChIInChI=1S/C27H38N2O3.C26H36N2O3.C25H34N2O3.C24H32N2O3.2C23H30N2O3.2C22H28N2O3.2C21H26N2O3.C20H24N2O3.11C2H6/c1-5-6-16-31-26-18-22(2)27(23(3)19-26)32-17-12-10-8-7-9-11-13-25-15-14-24(20-28-25)21-29-30-4;1-5-6-15-30-25-17-21(2)26(22(3)18-25)31-16-11-9-7-8-10-12-24-14-13-23(19-27-24)20-28-29-4;1-5-6-14-29-24-16-20(2)25(21(3)17-24)30-15-10-8-7-9-11-23-13-12-22(18-26-23)19-27-28-4;1-5-6-13-28-23-15-19(2)24(20(3)16-23)29-14-9-7-8-10-22-12-11-21(17-25-22)18-26-27-4;1-6-7-12-27-22-14-17(2)23(18(3)15-22)28-13-8-9-21-11-10-20(16-24-21)19(4)25-26-5;1-5-6-12-27-22-14-18(2)23(19(3)15-22)28-13-8-7-9-21-11-10-20(16-24-21)17-25-26-4;1-6-7-11-26-21-13-16(2)22(17(3)14-21)27-12-10-20-9-8-19(15-23-20)18(4)24-25-5;1-5-6-11-26-21-13-17(2)22(18(3)14-21)27-12-7-8-20-10-9-19(15-23-20)16-24-25-4;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;1-5-6-10-25-20-12-16(2)21(17(3)13-20)26-11-9-19-8-7-18(14-22-19)15-23-24-4;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;11*1-2/h5-6,14-15,18-21H,7-13,16-17H2,1-4H3;5-6,13-14,17-20H,7-12,15-16H2,1-4H3;5-6,12-13,16-19H,7-11,14-15H2,1-4H3;5-6,11-12,15-18H,7-10,13-14H2,1-4H3;6-7,10-11,14-16H,8-9,12-13H2,1-5H3;5-6,10-11,14-17H,7-9,12-13H2,1-4H3;6-9,13-15H,10-12H2,1-5H3;5-6,9-10,13-16H,7-8,11-12H2,1-4H3;6-9,11-13H,10,14H2,1-5H3;5-8,12-15H,9-11H2,1-4H3;5-8,10-13H,9,14H2,1-4H3;11*1-2H3/b6-5+,29-21?;6-5+,28-20?;6-5+,27-19?;6-5+,26-18?;7-6+,25-19?;6-5+,25-17?;7-6+,24-18?;6-5+,24-16?;7-6+,23-17?;6-5+,23-15?;6-5+,22-13?;;;;;;;;;;;
InChIKeyRFDMCTHUPNHHHV-SBBIUWHQSA-N
MW4552.34 g/mol
LogP67.76
Rot. Bonds119

About 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane

1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane (PubChem CID 160608102) has the molecular formula C276H398N22O33 and a molecular weight of 4552.34 g/mol. Its IUPAC name is 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane.

Molecular Properties

Compound Name1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane
PubChem CID160608102
Molecular FormulaC276H398N22O33
Molecular Weight4552.34 g/mol
Exact Mass4549.01
IUPAC Name1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane
SMILESC/C=C/COc1cc(C)c(OCCCCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCc2ccc(C(C)=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCc2ccc(C(C)=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCc2ccc(C=NOC)cn2)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=NOC)cn2)c(C)c1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC
InChIInChI=1S/C27H38N2O3.C26H36N2O3.C25H34N2O3.C24H32N2O3.2C23H30N2O3.2C22H28N2O3.2C21H26N2O3.C20H24N2O3.11C2H6/c1-5-6-16-31-26-18-22(2)27(23(3)19-26)32-17-12-10-8-7-9-11-13-25-15-14-24(20-28-25)21-29-30-4;1-5-6-15-30-25-17-21(2)26(22(3)18-25)31-16-11-9-7-8-10-12-24-14-13-23(19-27-24)20-28-29-4;1-5-6-14-29-24-16-20(2)25(21(3)17-24)30-15-10-8-7-9-11-23-13-12-22(18-26-23)19-27-28-4;1-5-6-13-28-23-15-19(2)24(20(3)16-23)29-14-9-7-8-10-22-12-11-21(17-25-22)18-26-27-4;1-6-7-12-27-22-14-17(2)23(18(3)15-22)28-13-8-9-21-11-10-20(16-24-21)19(4)25-26-5;1-5-6-12-27-22-14-18(2)23(19(3)15-22)28-13-8-7-9-21-11-10-20(16-24-21)17-25-26-4;1-6-7-11-26-21-13-16(2)22(17(3)14-21)27-12-10-20-9-8-19(15-23-20)18(4)24-25-5;1-5-6-11-26-21-13-17(2)22(18(3)14-21)27-12-7-8-20-10-9-19(15-23-20)16-24-25-4;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;1-5-6-10-25-20-12-16(2)21(17(3)13-20)26-11-9-19-8-7-18(14-22-19)15-23-24-4;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;11*1-2/h5-6,14-15,18-21H,7-13,16-17H2,1-4H3;5-6,13-14,17-20H,7-12,15-16H2,1-4H3;5-6,12-13,16-19H,7-11,14-15H2,1-4H3;5-6,11-12,15-18H,7-10,13-14H2,1-4H3;6-7,10-11,14-16H,8-9,12-13H2,1-5H3;5-6,10-11,14-17H,7-9,12-13H2,1-4H3;6-9,13-15H,10-12H2,1-5H3;5-6,9-10,13-16H,7-8,11-12H2,1-4H3;6-9,11-13H,10,14H2,1-5H3;5-8,12-15H,9-11H2,1-4H3;5-8,10-13H,9,14H2,1-4H3;11*1-2H3/b6-5+,29-21?;6-5+,28-20?;6-5+,27-19?;6-5+,26-18?;7-6+,25-19?;6-5+,25-17?;7-6+,24-18?;6-5+,24-16?;7-6+,23-17?;6-5+,23-15?;6-5+,22-13?;;;;;;;;;;;
InChIKeyRFDMCTHUPNHHHV-SBBIUWHQSA-N
XLogP67.76
TPSA582.34 Ų
H-Bond Donors
H-Bond Acceptors55
Rotatable Bonds119
Heavy Atoms331
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004552.34
LogP ≤ 567.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1055

Analyze 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane?
The IUPAC name of 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane (CID 160608102) is 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane.
What is the SMILES notation for 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane?
The canonical SMILES for 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane is C/C=C/COc1cc(C)c(OCCCCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCc2ccc(C(C)=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCCc2ccc(C=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCc2ccc(C(C)=NOC)cn2)c(C)c1.C/C=C/COc1cc(C)c(OCCc2ccc(C=NOC)cn2)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=NOC)cn2)c(C)c1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.
What is the InChIKey of 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane?
The InChIKey is RFDMCTHUPNHHHV-SBBIUWHQSA-N. The full InChI is InChI=1S/C27H38N2O3.C26H36N2O3.C25H34N2O3.C24H32N2O3.2C23H30N2O3.2C22H28N2O3.2C21H26N2O3.C20H24N2O3.11C2H6/c1-5-6-16-31-26-18-22(2)27(23(3)19-26)32-17-12-10-8-7-9-11-13-25-15-14-24(20-28-25)21-29-30-4;1-5-6-15-30-25-17-21(2)26(22(3)18-25)31-16-11-9-7-8-10-12-24-14-13-23(19-27-24)20-28-29-4;1-5-6-14-29-24-16-20(2)25(21(3)17-24)30-15-10-8-7-9-11-23-13-12-22(18-26-23)19-27-28-4;1-5-6-13-28-23-15-19(2)24(20(3)16-23)29-14-9-7-8-10-22-12-11-21(17-25-22)18-26-27-4;1-6-7-12-27-22-14-17(2)23(18(3)15-22)28-13-8-9-21-11-10-20(16-24-21)19(4)25-26-5;1-5-6-12-27-22-14-18(2)23(19(3)15-22)28-13-8-7-9-21-11-10-20(16-24-21)17-25-26-4;1-6-7-11-26-21-13-16(2)22(17(3)14-21)27-12-10-20-9-8-19(15-23-20)18(4)24-25-5;1-5-6-11-26-21-13-17(2)22(18(3)14-21)27-12-7-8-20-10-9-19(15-23-20)16-24-25-4;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;1-5-6-10-25-20-12-16(2)21(17(3)13-20)26-11-9-19-8-7-18(14-22-19)15-23-24-4;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;11*1-2/h5-6,14-15,18-21H,7-13,16-17H2,1-4H3;5-6,13-14,17-20H,7-12,15-16H2,1-4H3;5-6,12-13,16-19H,7-11,14-15H2,1-4H3;5-6,11-12,15-18H,7-10,13-14H2,1-4H3;6-7,10-11,14-16H,8-9,12-13H2,1-5H3;5-6,10-11,14-17H,7-9,12-13H2,1-4H3;6-9,13-15H,10-12H2,1-5H3;5-6,9-10,13-16H,7-8,11-12H2,1-4H3;6-9,11-13H,10,14H2,1-5H3;5-8,12-15H,9-11H2,1-4H3;5-8,10-13H,9,14H2,1-4H3;11*1-2H3/b6-5+,29-21?;6-5+,28-20?;6-5+,27-19?;6-5+,26-18?;7-6+,25-19?;6-5+,25-17?;7-6+,24-18?;6-5+,24-16?;7-6+,23-17?;6-5+,23-15?;6-5+,22-13?;;;;;;;;;;;.
What are the key properties of 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane?
1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane has a molecular weight of 4552.34 g/mol, XLogP of 67.76, 119 rotatable bonds, 0 hydrogen bond donors, and 55 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[2-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[6-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]hexyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[[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-methoxymethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentyl]-3-pyridinyl]-N-methoxymethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[3-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]propyl]-3-pyridinyl]-N-methoxymethanimine;ethane is sourced from PubChem (CID 160608102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).