ethyl 1-[4-methyl-2-[1-[2-(4-methylphenyl)-1H-indol-3-yl]-3-oxidanylidene-1H-isoindol-2-yl]pentanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-methyl-2-[1-[2-(4-methylphenyl)-1H-indol-3-yl]-3-oxidanylidene-1H-isoindol-2-yl]pentanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-methyl-2-[1-oxo-3-[2-(p-tolyl)-1H-indol-3-yl]isoindolin-2-yl]pentanoyl]piperidine-4-carboxylate CAS Name: 1-[4-methyl-2-[1-[2-(4-methylphenyl)-1H-indol-3-yl]-3-oxo-1H-isoindol-2-yl]-1-oxopentyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-methyl-2-[1-[2-(4-methylphenyl)-1H-indol-3-yl]-3-oxo-1H-isoindol-2-yl]pentanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[1-keto-3-[2-(p-tolyl)-1H-indol-3-yl]isoindolin-2-yl]-4-methyl-pentanoyl]isonipecotic acid ethyl ester Formula: C37H41N3O4 MolecularWeight: 591.73914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(CC(C)C)N2C(C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C6=CC=C(C=C6)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C(CC(C)C)N2C(C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C6=CC=C(C=C6)C

InChI

InChI=1S/C37H41N3O4/c1-5-44-37(43)26-18-20-39(21-19-26)36(42)31(22-23(2)3)40-34(27-10-6-7-11-28(27)35(40)41)32-29-12-8-9-13-30(29)38-33(32)25-16-14-24(4)15-17-25/h6-17,23,26,31,34,38H,5,18-22H2,1-4H3