3-(aminomethyl)-4-(3-aminophenyl)-6-chloranyl-2-methyl-isoquinolin-1-one hydrochloride

Systemtic Name: 3-(aminomethyl)-4-(3-aminophenyl)-6-chloranyl-2-methyl-isoquinolin-1-one hydrochloride Openeye Name: 3-(aminomethyl)-4-(3-aminophenyl)-6-chloro-2-methyl-isoquinolin-1-one hydrochloride CAS Name: 3-(aminomethyl)-4-(3-aminophenyl)-6-chloro-2-methyl-1-isoquinolinone hydrochloride IUPAC Name: 3-(aminomethyl)-4-(3-aminophenyl)-6-chloro-2-methylisoquinolin-1-one hydrochloride Traditional Name: 3-(aminomethyl)-4-(3-aminophenyl)-6-chloro-2-methyl-isocarbostyril hydrochloride Formula: C17H17Cl2N3O MolecularWeight: 350.24238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3O.ClH/c1-21-15(9-19)16(10-3-2-4-12(20)7-10)14-8-11(18)5-6-13(14)17(21)22;/h2-8H,9,19-20H2,1H3;1H