3-(1H-indol-3-yl)-2-(3-methyl-1-oxidanylidene-1-piperidin-1-yl-pentan-2-yl)-3H-isoindol-1-one

Systemtic Name: 3-(1H-indol-3-yl)-2-(3-methyl-1-oxidanylidene-1-piperidin-1-yl-pentan-2-yl)-3H-isoindol-1-one Openeye Name: 3-(1H-indol-3-yl)-2-[2-methyl-1-(piperidine-1-carbonyl)butyl]isoindolin-1-one CAS Name: 3-(1H-indol-3-yl)-2-[3-methyl-1-oxo-1-(1-piperidinyl)pentan-2-yl]-3H-isoindol-1-one IUPAC Name: 3-(1H-indol-3-yl)-2-(3-methyl-1-oxo-1-piperidin-1-ylpentan-2-yl)-3H-isoindol-1-one Traditional Name: 3-(1H-indol-3-yl)-2-[2-methyl-1-(piperidine-1-carbonyl)butyl]isoindolin-1-one Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3O2/c1-3-18(2)24(27(32)29-15-9-4-10-16-29)30-25(20-12-5-6-13-21(20)26(30)31)22-17-28-23-14-8-7-11-19(22)23/h5-8,11-14,17-18,24-25,28H,3-4,9-10,15-16H2,1-2H3