diethyl 5-[3-cyano-4-(7-methoxy-2-phenyl-1H-indol-3-yl)-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[3-cyano-4-(7-methoxy-2-phenyl-1H-indol-3-yl)-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[3-cyano-4-(7-methoxy-2-phenyl-1H-indol-3-yl)-2-oxo-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[3-cyano-4-(7-methoxy-2-phenyl-1H-indol-3-yl)-2-oxobut-3-enyl]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[3-cyano-4-(7-methoxy-2-phenyl-1H-indol-3-yl)-2-oxobut-3-enyl]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[3-cyano-2-keto-4-(7-methoxy-2-phenyl-1H-indol-3-yl)but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C31H28N2O6S MolecularWeight: 556.62882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)CC(=O)C(=CC2=C(NC3=C2C=CC=C3OC)C4=CC=CC=C4)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)CC(=O)C(=CC2=C(NC3=C2C=CC=C3OC)C4=CC=CC=C4)C#N

InChI

InChI=1S/C31H28N2O6S/c1-5-38-30(35)26-18(3)29(31(36)39-6-2)40-25(26)16-23(34)20(17-32)15-22-21-13-10-14-24(37-4)28(21)33-27(22)19-11-8-7-9-12-19/h7-15,33H,5-6,16H2,1-4H3