3-(aminomethyl)-2-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)isoquinolin-1-one hydrochloride

Systemtic Name: 3-(aminomethyl)-2-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)isoquinolin-1-one hydrochloride Openeye Name: 3-(aminomethyl)-2-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)isoquinolin-1-one hydrochloride CAS Name: 3-(aminomethyl)-2-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)-1-isoquinolinone hydrochloride IUPAC Name: 3-(aminomethyl)-2-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)isoquinolin-1-one hydrochloride Traditional Name: 3-(aminomethyl)-4-(2-methoxyethoxy)-2-neopentyl-isocarbostyril hydrochloride Formula: C18H27ClN2O3 MolecularWeight: 354.87158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C(=C(C2=CC=CC=C2C1=O)OCCOC)CN.Cl

Isomeric SMILES

CC(C)(C)CN1C(=C(C2=CC=CC=C2C1=O)OCCOC)CN.Cl

InChI

InChI=1S/C18H26N2O3.ClH/c1-18(2,3)12-20-15(11-19)16(23-10-9-22-4)13-7-5-6-8-14(13)17(20)21;/h5-8H,9-12,19H2,1-4H3;1H