diethyl 2,5-dicyano-2-(3-methoxy-5-methylsulfanyl-4-propoxy-phenyl)-5-(3,4,5-trimethoxyphenyl)hexanedioate

Systemtic Name: diethyl 2,5-dicyano-2-(3-methoxy-5-methylsulfanyl-4-propoxy-phenyl)-5-(3,4,5-trimethoxyphenyl)hexanedioate Openeye Name: diethyl 2,5-dicyano-2-(3-methoxy-5-methylsulfanyl-4-propoxy-phenyl)-5-(3,4,5-trimethoxyphenyl)hexanedioate CAS Name: 2,5-dicyano-2-[3-methoxy-5-(methylthio)-4-propoxyphenyl]-5-(3,4,5-trimethoxyphenyl)hexanedioic acid diethyl ester IUPAC Name: diethyl 2,5-dicyano-2-(3-methoxy-5-methylsulfanyl-4-propoxyphenyl)-5-(3,4,5-trimethoxyphenyl)hexanedioate Traditional Name: 2,5-dicyano-2-[3-methoxy-5-(methylthio)-4-propoxy-phenyl]-5-(3,4,5-trimethoxyphenyl)adipic acid diethyl ester Formula: C32H40N2O9S MolecularWeight: 628.733

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1SC)C(CCC(C#N)(C2=CC(=C(C(=C2)OC)OC)OC)C(=O)OCC)(C#N)C(=O)OCC)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1SC)C(CCC(C#N)(C2=CC(=C(C(=C2)OC)OC)OC)C(=O)OCC)(C#N)C(=O)OCC)OC

InChI

InChI=1S/C32H40N2O9S/c1-9-14-43-28-25(39-6)17-22(18-26(28)44-8)32(20-34,30(36)42-11-3)13-12-31(19-33,29(35)41-10-2)21-15-23(37-4)27(40-7)24(16-21)38-5/h15-18H,9-14H2,1-8H3