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

Systemtic Name: ethyl 1-[4-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]pentanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxo-isoindolin-2-yl]pentanoyl]piperidine-4-carboxylate CAS Name: 1-[4-methyl-2-[1-(1-methyl-2-phenyl-3-indolyl)-3-oxo-1H-isoindol-2-yl]-1-oxopentyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-methyl-2-[1-(1-methyl-2-phenylindol-3-yl)-3-oxo-1H-isoindol-2-yl]pentanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[1-keto-3-(1-methyl-2-phenyl-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(N(C5=CC=CC=C54)C)C6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C(CC(C)C)N2C(C3=CC=CC=C3C2=O)C4=C(N(C5=CC=CC=C54)C)C6=CC=CC=C6

InChI

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