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

Systemtic Name: diethyl 2-[9-cyano-3-methyl-2-(4-methylphenyl)azuleno[1,2-c]pyrrol-1-yl]but-2-enedioate Openeye Name: diethyl 2-[9-cyano-3-methyl-2-(p-tolyl)azuleno[1,2-c]pyrrol-1-yl]but-2-enedioate CAS Name: 2-[9-cyano-3-methyl-2-(4-methylphenyl)-1-azuleno[1,2-c]pyrrolyl]-2-butenedioic acid diethyl ester IUPAC Name: diethyl 2-[9-cyano-3-methyl-2-(4-methylphenyl)azuleno[1,2-c]pyrrol-1-yl]but-2-enedioate Traditional Name: 2-[9-cyano-3-methyl-2-(p-tolyl)azuleno[1,2-c]pyrrol-1-yl]but-2-enedioic acid diethyl ester Formula: C29H26N2O4 MolecularWeight: 466.52774

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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)C)C)C#N)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C29H26N2O4/c1-5-34-25(32)16-23(29(33)35-6-2)28-27-24(17-30)21-10-8-7-9-11-22(21)26(27)19(4)31(28)20-14-12-18(3)13-15-20/h7-16H,5-6H2,1-4H3