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

Systemtic Name: ethyl 1-[3-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]pentanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxo-isoindolin-2-yl]pentanoyl]piperidine-4-carboxylate CAS Name: 1-[3-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-[3-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]-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(N(C5=CC=CC=C54)C)C6=CC=CC=C6

Isomeric SMILES

CCC(C)C(C(=O)N1CCC(CC1)C(=O)OCC)N2C(C3=CC=CC=C3C2=O)C4=C(N(C5=CC=CC=C54)C)C6=CC=CC=C6

InChI

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