2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenyl-propan-1-one hydrochloride

Systemtic Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenyl-propan-1-one hydrochloride Openeye Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenyl-propan-1-one hydrochloride CAS Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenyl-1-propanone hydrochloride IUPAC Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenylpropan-1-one hydrochloride Traditional Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenyl-propan-1-one hydrochloride Formula: C20H22ClNO MolecularWeight: 327.84778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(CC2=CC=CC=C21)(C)C)C(=O)C3=CC=CC=C3.Cl

Isomeric SMILES

CC(C1=NC(CC2=CC=CC=C21)(C)C)C(=O)C3=CC=CC=C3.Cl

InChI

InChI=1S/C20H21NO.ClH/c1-14(19(22)15-9-5-4-6-10-15)18-17-12-8-7-11-16(17)13-20(2,3)21-18;/h4-12,14H,13H2,1-3H3;1H