3-(aminomethyl)-4-(4-methylphenyl)-2-(2-methylpropyl)isoquinolin-1-one hydrochloride

Systemtic Name: 3-(aminomethyl)-4-(4-methylphenyl)-2-(2-methylpropyl)isoquinolin-1-one hydrochloride Openeye Name: 3-(aminomethyl)-2-isobutyl-4-(p-tolyl)isoquinolin-1-one hydrochloride CAS Name: 3-(aminomethyl)-4-(4-methylphenyl)-2-(2-methylpropyl)-1-isoquinolinone hydrochloride IUPAC Name: 3-(aminomethyl)-4-(4-methylphenyl)-2-(2-methylpropyl)isoquinolin-1-one hydrochloride Traditional Name: 3-(aminomethyl)-2-isobutyl-4-(p-tolyl)isocarbostyril hydrochloride Formula: C21H25ClN2O MolecularWeight: 356.889

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(C(=O)C3=CC=CC=C32)CC(C)C)CN.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(C(=O)C3=CC=CC=C32)CC(C)C)CN.Cl

InChI

InChI=1S/C21H24N2O.ClH/c1-14(2)13-23-19(12-22)20(16-10-8-15(3)9-11-16)17-6-4-5-7-18(17)21(23)24;/h4-11,14H,12-13,22H2,1-3H3;1H