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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2C(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4C5=CC=CC=C5)CCC(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1CN(CCN1)C2C(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4C5=CC=CC=C5)CCC(C6=CC=CC=C6)C7=CC=CC=C7

InChI

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