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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CN2CCC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CC(C1)CN2CCC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

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