3-[3-(aminomethyl)-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinolin-6-yl]propanamide hydrochloride

Systemtic Name: 3-[3-(aminomethyl)-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinolin-6-yl]propanamide hydrochloride Openeye Name: 3-[3-(aminomethyl)-2-isobutyl-1-oxo-4-phenyl-6-isoquinolyl]propanamide hydrochloride CAS Name: 3-[3-(aminomethyl)-2-(2-methylpropyl)-1-oxo-4-phenyl-6-isoquinolinyl]propanamide hydrochloride IUPAC Name: 3-[3-(aminomethyl)-2-(2-methylpropyl)-1-oxo-4-phenylisoquinolin-6-yl]propanamide hydrochloride Traditional Name: 3-[3-(aminomethyl)-2-isobutyl-1-keto-4-phenyl-6-isoquinolyl]propionamide hydrochloride Formula: C23H28ClN3O2 MolecularWeight: 413.94032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)CCC(=O)N)C3=CC=CC=C3)CN.Cl

Isomeric SMILES

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)CCC(=O)N)C3=CC=CC=C3)CN.Cl

InChI

InChI=1S/C23H27N3O2.ClH/c1-15(2)14-26-20(13-24)22(17-6-4-3-5-7-17)19-12-16(9-11-21(25)27)8-10-18(19)23(26)28;/h3-8,10,12,15H,9,11,13-14,24H2,1-2H3,(H2,25,27);1H