(3S)-3-(1H-indol-3-yl)-2-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]-3H-isoindol-1-one

Systemtic Name: (3S)-3-(1H-indol-3-yl)-2-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]-3H-isoindol-1-one Openeye Name: (3S)-3-(1H-indol-3-yl)-2-[(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]isoindolin-1-one CAS Name: (3S)-3-(1H-indol-3-yl)-2-[(2S)-1-oxo-1-(1-piperidinyl)propan-2-yl]-3H-isoindol-1-one IUPAC Name: (3S)-3-(1H-indol-3-yl)-2-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]-3H-isoindol-1-one Traditional Name: (3S)-3-(1H-indol-3-yl)-2-[(1S)-2-keto-1-methyl-2-piperidino-ethyl]isoindolin-1-one Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)N2C(C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

C[C@@H](C(=O)N1CCCCC1)N2[C@@H](C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C24H25N3O2/c1-16(23(28)26-13-7-2-8-14-26)27-22(18-10-3-4-11-19(18)24(27)29)20-15-25-21-12-6-5-9-17(20)21/h3-6,9-12,15-16,22,25H,2,7-8,13-14H2,1H3/t16-,22-/m0/s1