3-[2-(1-phenylethylamino)ethyl]-6-[(2-phenylphenyl)methoxy]-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: 3-[2-(1-phenylethylamino)ethyl]-6-[(2-phenylphenyl)methoxy]-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: 3-[2-(1-phenylethylamino)ethyl]-6-[(2-phenylphenyl)methoxy]-3,4-dihydro-2H-isoquinolin-1-one CAS Name: 3-[2-(1-phenylethylamino)ethyl]-6-[(2-phenylphenyl)methoxy]-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: 3-[2-(1-phenylethylamino)ethyl]-6-[(2-phenylphenyl)methoxy]-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: 6-(2-phenylbenzyl)oxy-3-[2-(1-phenylethylamino)ethyl]-3,4-dihydroisocarbostyril Formula: C32H32N2O2 MolecularWeight: 476.60868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCCC2CC3=C(C=CC(=C3)OCC4=CC=CC=C4C5=CC=CC=C5)C(=O)N2

Isomeric SMILES

CC(C1=CC=CC=C1)NCCC2CC3=C(C=CC(=C3)OCC4=CC=CC=C4C5=CC=CC=C5)C(=O)N2

InChI

InChI=1S/C32H32N2O2/c1-23(24-10-4-2-5-11-24)33-19-18-28-20-27-21-29(16-17-31(27)32(35)34-28)36-22-26-14-8-9-15-30(26)25-12-6-3-7-13-25/h2-17,21,23,28,33H,18-20,22H2,1H3,(H,34,35)