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

Systemtic Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(4-ethoxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(4-ethoxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 3-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-[(4-ethoxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(4-ethoxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 3-[4-(3,3-diphenylpropyl)piperazino]-2-(4-ethoxybenzyl)-3,4-dihydroisocarbostyril Formula: C37H41N3O2 MolecularWeight: 559.74034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2C(CC3=CC=CC=C3C2=O)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2C(CC3=CC=CC=C3C2=O)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C37H41N3O2/c1-2-42-33-19-17-29(18-20-33)28-40-36(27-32-15-9-10-16-35(32)37(40)41)39-25-23-38(24-26-39)22-21-34(30-11-5-3-6-12-30)31-13-7-4-8-14-31/h3-20,34,36H,2,21-28H2,1H3