3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(3-methylphenyl)methyl]-3H-isoindol-1-one

Systemtic Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(3-methylphenyl)methyl]-3H-isoindol-1-one Openeye Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-(m-tolylmethyl)isoindolin-1-one CAS Name: 3-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-[(3-methylphenyl)methyl]-3H-isoindol-1-one IUPAC Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(3-methylphenyl)methyl]-3H-isoindol-1-one Traditional Name: 3-[4-(3,3-diphenylpropyl)piperazino]-2-(3-methylbenzyl)isoindolin-1-one Formula: C35H37N3O MolecularWeight: 515.68778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(C3=CC=CC=C3C2=O)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(C3=CC=CC=C3C2=O)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H37N3O/c1-27-11-10-12-28(25-27)26-38-34(32-17-8-9-18-33(32)35(38)39)37-23-21-36(22-24-37)20-19-31(29-13-4-2-5-14-29)30-15-6-3-7-16-30/h2-18,25,31,34H,19-24,26H2,1H3