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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCC(CC1)C(=O)OCC)N2C(C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C6=CC=C(C=C6)C

Isomeric SMILES

CCC(C)C(C(=O)N1CCC(CC1)C(=O)OCC)N2C(C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C6=CC=C(C=C6)C

InChI

InChI=1S/C37H41N3O4/c1-5-24(4)33(36(42)39-21-19-26(20-22-39)37(43)44-6-2)40-34(27-11-7-8-12-28(27)35(40)41)31-29-13-9-10-14-30(29)38-32(31)25-17-15-23(3)16-18-25/h7-18,24,26,33-34,38H,5-6,19-22H2,1-4H3