2-[3-(4-phenyl-2,3-dihydro-1H-isoquinolin-4-yl)propyl]isoindole-1,3-dione hydrochloride

Systemtic Name: 2-[3-(4-phenyl-2,3-dihydro-1H-isoquinolin-4-yl)propyl]isoindole-1,3-dione hydrochloride Openeye Name: 2-[3-(4-phenyl-2,3-dihydro-1H-isoquinolin-4-yl)propyl]isoindoline-1,3-dione hydrochloride CAS Name: 2-[3-(4-phenyl-2,3-dihydro-1H-isoquinolin-4-yl)propyl]isoindole-1,3-dione hydrochloride IUPAC Name: 2-[3-(4-phenyl-2,3-dihydro-1H-isoquinolin-4-yl)propyl]isoindole-1,3-dione hydrochloride Traditional Name: 2-[3-(4-phenyl-2,3-dihydro-1H-isoquinolin-4-yl)propyl]isoindoline-1,3-quinone hydrochloride Formula: C26H25ClN2O2 MolecularWeight: 432.9419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(CN1)(CCCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5.Cl

Isomeric SMILES

C1C2=CC=CC=C2C(CN1)(CCCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5.Cl

InChI

InChI=1S/C26H24N2O2.ClH/c29-24-21-12-5-6-13-22(21)25(30)28(24)16-8-15-26(20-10-2-1-3-11-20)18-27-17-19-9-4-7-14-23(19)26;/h1-7,9-14,27H,8,15-18H2;1H