diethyl 2-[9-cyano-2-(4-methoxyphenyl)-3-methyl-azuleno[1,2-c]pyrrol-1-yl]but-2-enedioate

Systemtic Name: diethyl 2-[9-cyano-2-(4-methoxyphenyl)-3-methyl-azuleno[1,2-c]pyrrol-1-yl]but-2-enedioate Openeye Name: diethyl 2-[9-cyano-2-(4-methoxyphenyl)-3-methyl-azuleno[1,2-c]pyrrol-1-yl]but-2-enedioate CAS Name: 2-[9-cyano-2-(4-methoxyphenyl)-3-methyl-1-azuleno[1,2-c]pyrrolyl]-2-butenedioic acid diethyl ester IUPAC Name: diethyl 2-[9-cyano-2-(4-methoxyphenyl)-3-methylazuleno[1,2-c]pyrrol-1-yl]but-2-enedioate Traditional Name: 2-[9-cyano-2-(4-methoxyphenyl)-3-methyl-azuleno[1,2-c]pyrrol-1-yl]but-2-enedioic acid diethyl ester Formula: C29H26N2O5 MolecularWeight: 482.52714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C1=C2C(=C3C=CC=CC=C3C2=C(N1C4=CC=C(C=C4)OC)C)C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C=C(C1=C2C(=C3C=CC=CC=C3C2=C(N1C4=CC=C(C=C4)OC)C)C#N)C(=O)OCC

InChI

InChI=1S/C29H26N2O5/c1-5-35-25(32)16-23(29(33)36-6-2)28-27-24(17-30)21-10-8-7-9-11-22(21)26(27)18(3)31(28)19-12-14-20(34-4)15-13-19/h7-16H,5-6H2,1-4H3