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

Systemtic Name: 2-(cyclopentylmethyl)-7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-(cyclopentylmethyl)-7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-(cyclopentylmethyl)-7-[4-(3,3-diphenylpropyl)-1-piperazinyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-(cyclopentylmethyl)-7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-(cyclopentylmethyl)-7-[4-(3,3-diphenylpropyl)piperazino]-3,4-dihydroisocarbostyril Formula: C34H41N3O MolecularWeight: 507.70884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CN2CCC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(C1)CN2CCC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H41N3O/c38-34-33-25-31(16-15-30(33)17-20-37(34)26-27-9-7-8-10-27)36-23-21-35(22-24-36)19-18-32(28-11-3-1-4-12-28)29-13-5-2-6-14-29/h1-6,11-16,25,27,32H,7-10,17-24,26H2