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

Systemtic Name: 2-[3-(aminomethyl)-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinolin-6-yl]oxy-2-methyl-propanamide hydrochloride Openeye Name: 2-[[3-(aminomethyl)-2-isobutyl-1-oxo-4-phenyl-6-isoquinolyl]oxy]-2-methyl-propanamide hydrochloride CAS Name: 2-[[3-(aminomethyl)-2-(2-methylpropyl)-1-oxo-4-phenyl-6-isoquinolinyl]oxy]-2-methylpropanamide hydrochloride IUPAC Name: 2-[3-(aminomethyl)-2-(2-methylpropyl)-1-oxo-4-phenylisoquinolin-6-yl]oxy-2-methylpropanamide hydrochloride Traditional Name: 2-[[3-(aminomethyl)-2-isobutyl-1-keto-4-phenyl-6-isoquinolyl]oxy]-2-methyl-propionamide hydrochloride Formula: C24H30ClN3O3 MolecularWeight: 443.9663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O3.ClH/c1-15(2)14-27-20(13-25)21(16-8-6-5-7-9-16)19-12-17(10-11-18(19)22(27)28)30-24(3,4)23(26)29;/h5-12,15H,13-14,25H2,1-4H3,(H2,26,29);1H