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

Systemtic Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-(2-oxidanyl-2-phenyl-ethyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-(2-hydroxy-2-phenyl-ethyl)-3,4-dihydroisoquinolin-1-one CAS Name: 7-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-(2-hydroxy-2-phenylethyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-(2-hydroxy-2-phenylethyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 7-[4-(3,3-diphenylpropyl)piperazino]-2-(2-hydroxy-2-phenyl-ethyl)-3,4-dihydroisocarbostyril Formula: C36H39N3O2 MolecularWeight: 545.71376

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C=CC(=C2)N3CCN(CC3)CCC(C4=CC=CC=C4)C5=CC=CC=C5)CC(C6=CC=CC=C6)O

Isomeric SMILES

C1CN(C(=O)C2=C1C=CC(=C2)N3CCN(CC3)CCC(C4=CC=CC=C4)C5=CC=CC=C5)CC(C6=CC=CC=C6)O

InChI

InChI=1S/C36H39N3O2/c40-35(31-14-8-3-9-15-31)27-39-21-18-30-16-17-32(26-34(30)36(39)41)38-24-22-37(23-25-38)20-19-33(28-10-4-1-5-11-28)29-12-6-2-7-13-29/h1-17,26,33,35,40H,18-25,27H2