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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2CN(C(=O)C3=C2C=CC(=C3)CCC(C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6C7=CC=CC=C7

Isomeric SMILES

C1CN(CCN1)C2CN(C(=O)C3=C2C=CC(=C3)CCC(C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6C7=CC=CC=C7

InChI

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