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

Systemtic Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(2-phenylphenyl)methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(2-phenylphenyl)methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 7-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-[(2-phenylphenyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(2-phenylphenyl)methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 7-[4-(3,3-diphenylpropyl)piperazino]-2-(2-phenylbenzyl)-3,4-dihydroisocarbostyril Formula: C41H41N3O MolecularWeight: 591.78374

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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)CC6=CC=CC=C6C7=CC=CC=C7

Isomeric SMILES

C1CN(C(=O)C2=C1C=CC(=C2)N3CCN(CC3)CCC(C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6C7=CC=CC=C7

InChI

InChI=1S/C41H41N3O/c45-41-40-30-37(21-20-35(40)22-25-44(41)31-36-18-10-11-19-38(36)32-12-4-1-5-13-32)43-28-26-42(27-29-43)24-23-39(33-14-6-2-7-15-33)34-16-8-3-9-17-34/h1-21,30,39H,22-29,31H2