bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane

C242H349N17O32S3 — CID 158831627

IUPACbis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane
SMILESC.C/C=C/COc1cc(C)c(OCOc2ccc(C(C)=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCOc2ccc(C(C)=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCS(C)(C)c2ccc(C=NOC)cc2)c(C)c1.C/C=C/COc1cc(C)c(OCS(C)(CC)c2ccc(C=NOC)cc2)c(C)c1.C/C=C/COc1cc(C)c(OCS(CC)(CC)c2ccc(C=NOC)cc2)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)nc2)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)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)nc2)c(C)c1.C=C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC
InChIInChI=1S/C25H35NO3S.C24H33NO3S.C23H31NO3S.2C21H26N2O4.5C21H26N2O3.10C2H6.C2H4.CH4/c1-7-10-15-28-23-16-20(4)25(21(5)17-23)29-19-30(8-2,9-3)24-13-11-22(12-14-24)18-26-27-6;1-7-9-14-27-22-15-19(3)24(20(4)16-22)28-18-29(6,8-2)23-12-10-21(11-13-23)17-25-26-5;1-7-8-13-26-21-14-18(2)23(19(3)15-21)27-17-28(5,6)22-11-9-20(10-12-22)16-24-25-4;2*1-6-7-10-25-19-11-15(2)21(16(3)12-19)27-14-26-18-8-9-20(22-13-18)17(4)23-24-5;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;11*1-2;/h7,10-14,16-18H,8-9,15,19H2,1-6H3;7,9-13,15-17H,8,14,18H2,1-6H3;7-12,14-16H,13,17H2,1-6H3;2*6-9,11-13H,10,14H2,1-5H3;5*6-9,11-13H,10,14H2,1-5H3;10*1-2H3;1-2H2;1H4/b10-7+,26-18?;9-7+,25-17?;8-7+,24-16?;7*7-6+,23-17?;;;;;;;;;;;;
InChIKeyIXCQGFXJKXMVJT-OCHVWGLHSA-N
MW4104.74 g/mol
LogP61.86
Rot. Bonds88

About bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane

bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane (PubChem CID 158831627) has the molecular formula C242H349N17O32S3 and a molecular weight of 4104.74 g/mol. Its IUPAC name is bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane.

Molecular Properties

Compound Namebis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane
PubChem CID158831627
Molecular FormulaC242H349N17O32S3
Molecular Weight4104.74 g/mol
Exact Mass4101.54
IUPAC Namebis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane
SMILESC.C/C=C/COc1cc(C)c(OCOc2ccc(C(C)=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCOc2ccc(C(C)=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCS(C)(C)c2ccc(C=NOC)cc2)c(C)c1.C/C=C/COc1cc(C)c(OCS(C)(CC)c2ccc(C=NOC)cc2)c(C)c1.C/C=C/COc1cc(C)c(OCS(CC)(CC)c2ccc(C=NOC)cc2)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)nc2)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)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)nc2)c(C)c1.C=C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC
InChIInChI=1S/C25H35NO3S.C24H33NO3S.C23H31NO3S.2C21H26N2O4.5C21H26N2O3.10C2H6.C2H4.CH4/c1-7-10-15-28-23-16-20(4)25(21(5)17-23)29-19-30(8-2,9-3)24-13-11-22(12-14-24)18-26-27-6;1-7-9-14-27-22-15-19(3)24(20(4)16-22)28-18-29(6,8-2)23-12-10-21(11-13-23)17-25-26-5;1-7-8-13-26-21-14-18(2)23(19(3)15-21)27-17-28(5,6)22-11-9-20(10-12-22)16-24-25-4;2*1-6-7-10-25-19-11-15(2)21(16(3)12-19)27-14-26-18-8-9-20(22-13-18)17(4)23-24-5;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;11*1-2;/h7,10-14,16-18H,8-9,15,19H2,1-6H3;7,9-13,15-17H,8,14,18H2,1-6H3;7-12,14-16H,13,17H2,1-6H3;2*6-9,11-13H,10,14H2,1-5H3;5*6-9,11-13H,10,14H2,1-5H3;10*1-2H3;1-2H2;1H4/b10-7+,26-18?;9-7+,25-17?;8-7+,24-16?;7*7-6+,23-17?;;;;;;;;;;;;
InChIKeyIXCQGFXJKXMVJT-OCHVWGLHSA-N
XLogP61.86
TPSA509.19 Ų
H-Bond Donors
H-Bond Acceptors49
Rotatable Bonds88
Heavy Atoms294
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004104.74
LogP ≤ 561.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1049

Analyze bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane with MolForge

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Related Compounds

bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxypropan-1-imine);bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-2,2,2-trifluoro-N-methoxyethanimine);1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxypropan-1-imine;hexakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-2,2,2-trifluoro-N-methoxyethanimine);ethane;ethene;methane
CID 157662021
bis(1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-3-pyridinyl]-N-methoxypropan-1-imine);bis(1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-3-pyridinyl]-2,2,2-trifluoro-N-methoxyethanimine);1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-N-methoxypropan-1-imine;hexakis(1-[6-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-3-pyridinyl]-2,2,2-trifluoro-N-methoxyethanimine);ethane;ethene;methane
CID 160748752
2-[4-[4-[4-[4-[4-[4-[4-[4-[6-[4-[2-(4-Ethenylphenyl)-4-[3-(4-ethenylphenyl)-4-[2-[2-(4-ethenylphenyl)-4-[3-(4-ethenylphenyl)-4-[4-[4-[4-[4-[2-(4-ethenylphenyl)-4-[3-(4-ethenylphenyl)-4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]-2,5-dipyridin-3-ylphenoxy]phenyl]sulfonylphenoxy]-2,5-dipyridin-3-ylphenoxy]phenyl]sulfonylphenyl]ethyl]phenyl]sulfonylphenoxy]phenyl]-3-pyridinyl]phenoxy]phenyl]sulfonylphenoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine
CID 88853463
(Z)-1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butoxy]-3-pyridinyl]-N-methoxyethanimine;(Z)-1-[6-[1-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;(Z)-1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptoxy]-3-pyridinyl]-N-methoxyethanimine;(Z)-1-[6-[9-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]nonoxy]-3-pyridinyl]-N-methoxyethanimine;(Z)-1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octoxy]-3-pyridinyl]-N-methoxyethanimine;(Z)-1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentoxy]-3-pyridinyl]-N-methoxyethanimine
CID 91072863
CID 158312491
CID 158312491
CID 158877195
CID 158877195
CID 158938955
CID 158938955
5-(4-Methylpentyl)-2-[4-[[4-(4-methylpentyl)cyclohexyl]methylsulfanyl]phenyl]pyridine;[6-(4-octoxyphenyl)-3-pyridinyl] cyclohexanecarboxylate;[6-(4-octoxyphenyl)-3-pyridinyl] 4-(4-methylpentyl)cyclohexane-1-carboxylate;[6-(4-octylphenyl)-3-pyridinyl] cyclohexanecarboxylate;[6-(4-octylphenyl)-3-pyridinyl] 4-(4-methylpentyl)cyclohexane-1-carboxylate
CID 159361163
1-[6-[4-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]butoxy]-3-pyridinyl]-N-methoxyethanimine;1-[6-[1-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]ethyl]-3-pyridinyl]-N-methoxyethanimine;1-[6-[7-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]heptoxy]-3-pyridinyl]-N-methoxyethanimine;1-[6-[9-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]nonoxy]-3-pyridinyl]-N-methoxyethanimine;1-[6-[8-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]octoxy]-3-pyridinyl]-N-methoxyethanimine;1-[6-[5-[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]pentoxy]-3-pyridinyl]-N-methoxyethanimine;ethane
CID 159592563
tetrakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);tetrakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxypropan-1-imine);ethane;ethene;methane
CID 159686464
bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);tetrakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxymethanimine);ethane;ethene;methane
CID 160488463
CID 160608102
CID 160608102

Frequently Asked Questions

What is the IUPAC name of bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane?
The IUPAC name of bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane (CID 158831627) is bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane.
What is the SMILES notation for bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane?
The canonical SMILES for bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane is C.C/C=C/COc1cc(C)c(OCOc2ccc(C(C)=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCOc2ccc(C(C)=NOC)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCS(C)(C)c2ccc(C=NOC)cc2)c(C)c1.C/C=C/COc1cc(C)c(OCS(C)(CC)c2ccc(C=NOC)cc2)c(C)c1.C/C=C/COc1cc(C)c(OCS(CC)(CC)c2ccc(C=NOC)cc2)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)nc2)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)nc2)c(C)c1.C/C=C/COc1cc(C)c(OCc2ccc(C(C)=NOC)nc2)c(C)c1.C=C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.
What is the InChIKey of bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane?
The InChIKey is IXCQGFXJKXMVJT-OCHVWGLHSA-N. The full InChI is InChI=1S/C25H35NO3S.C24H33NO3S.C23H31NO3S.2C21H26N2O4.5C21H26N2O3.10C2H6.C2H4.CH4/c1-7-10-15-28-23-16-20(4)25(21(5)17-23)29-19-30(8-2,9-3)24-13-11-22(12-14-24)18-26-27-6;1-7-9-14-27-22-15-19(3)24(20(4)16-22)28-18-29(6,8-2)23-12-10-21(11-13-23)17-25-26-5;1-7-8-13-26-21-14-18(2)23(19(3)15-21)27-17-28(5,6)22-11-9-20(10-12-22)16-24-25-4;2*1-6-7-10-25-19-11-15(2)21(16(3)12-19)27-14-26-18-8-9-20(22-13-18)17(4)23-24-5;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;11*1-2;/h7,10-14,16-18H,8-9,15,19H2,1-6H3;7,9-13,15-17H,8,14,18H2,1-6H3;7-12,14-16H,13,17H2,1-6H3;2*6-9,11-13H,10,14H2,1-5H3;5*6-9,11-13H,10,14H2,1-5H3;10*1-2H3;1-2H2;1H4/b10-7+,26-18?;9-7+,25-17?;8-7+,24-16?;7*7-6+,23-17?;;;;;;;;;;;;.
What are the key properties of bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane?
bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane has a molecular weight of 4104.74 g/mol, XLogP of 61.86, 88 rotatable bonds, 0 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methoxy]-2-pyridinyl]-N-methoxyethanimine);1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-diethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-dimethyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;1-[4-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl-ethyl-methyl-λ4-sulfanyl]phenyl]-N-methoxymethanimine;pentakis(1-[5-[[4-[(E)-but-2-enoxy]-2,6-dimethylphenoxy]methyl]-2-pyridinyl]-N-methoxyethanimine);ethane;ethene;methane is sourced from PubChem (CID 158831627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).