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

Systemtic Name: 3-(aminomethyl)-6-chloranyl-2-methyl-4-(3-nitrophenyl)isoquinolin-1-one hydrochloride Openeye Name: 3-(aminomethyl)-6-chloro-2-methyl-4-(3-nitrophenyl)isoquinolin-1-one hydrochloride CAS Name: 3-(aminomethyl)-6-chloro-2-methyl-4-(3-nitrophenyl)-1-isoquinolinone hydrochloride IUPAC Name: 3-(aminomethyl)-6-chloro-2-methyl-4-(3-nitrophenyl)isoquinolin-1-one hydrochloride Traditional Name: 3-(aminomethyl)-6-chloro-2-methyl-4-(3-nitrophenyl)isocarbostyril hydrochloride Formula: C17H15Cl2N3O3 MolecularWeight: 380.2253

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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+](=O)[O-])CN.Cl

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-])CN.Cl

InChI

InChI=1S/C17H14ClN3O3.ClH/c1-20-15(9-19)16(10-3-2-4-12(7-10)21(23)24)14-8-11(18)5-6-13(14)17(20)22;/h2-8H,9,19H2,1H3;1H