2-cyclohexyl-4-[2-(1,1-diphenylethyl)piperazin-1-yl]-3H-isoindol-1-one

Systemtic Name: 2-cyclohexyl-4-[2-(1,1-diphenylethyl)piperazin-1-yl]-3H-isoindol-1-one Openeye Name: 2-cyclohexyl-4-[2-(1,1-diphenylethyl)piperazin-1-yl]isoindolin-1-one CAS Name: 2-cyclohexyl-4-[2-(1,1-diphenylethyl)-1-piperazinyl]-3H-isoindol-1-one IUPAC Name: 2-cyclohexyl-4-[2-(1,1-diphenylethyl)piperazin-1-yl]-3H-isoindol-1-one Traditional Name: 2-cyclohexyl-4-[2-(1,1-diphenylethyl)piperazino]isoindolin-1-one Formula: C32H37N3O MolecularWeight: 479.65568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CNCCN1C2=CC=CC3=C2CN(C3=O)C4CCCCC4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C1CNCCN1C2=CC=CC3=C2CN(C3=O)C4CCCCC4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H37N3O/c1-32(24-12-5-2-6-13-24,25-14-7-3-8-15-25)30-22-33-20-21-34(30)29-19-11-18-27-28(29)23-35(31(27)36)26-16-9-4-10-17-26/h2-3,5-8,11-15,18-19,26,30,33H,4,9-10,16-17,20-23H2,1H3