2-cyclopentyl-7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-cyclopentyl-7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-cyclopentyl-7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-cyclopentyl-7-[4-(3,3-diphenylpropyl)-1-piperazinyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-cyclopentyl-7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-cyclopentyl-7-[4-(3,3-diphenylpropyl)piperazino]-3,4-dihydroisocarbostyril Formula: C33H39N3O MolecularWeight: 493.68226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(C1)N2CCC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H39N3O/c37-33-32-25-30(16-15-28(32)17-20-36(33)29-13-7-8-14-29)35-23-21-34(22-24-35)19-18-31(26-9-3-1-4-10-26)27-11-5-2-6-12-27/h1-6,9-12,15-16,25,29,31H,7-8,13-14,17-24H2