(5-chloranyl-2-oxidanyl-phenyl)-(3-cyano-6,7-dimethoxy-quinolin-4-yl)azanium chloride

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)-(3-cyano-6,7-dimethoxy-quinolin-4-yl)azanium chloride Openeye Name: (5-chloro-2-hydroxy-phenyl)-(3-cyano-6,7-dimethoxy-4-quinolyl)ammonium chloride CAS Name: (5-chloro-2-hydroxyphenyl)-(3-cyano-6,7-dimethoxy-4-quinolinyl)ammonium chloride IUPAC Name: (5-chloro-2-hydroxyphenyl)-(3-cyano-6,7-dimethoxyquinolin-4-yl)azanium chloride Traditional Name: (5-chloro-2-hydroxy-phenyl)-(3-cyano-6,7-dimethoxy-4-quinolyl)ammonium chloride Formula: C18H15Cl2N3O3 MolecularWeight: 392.236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)[NH2+]C3=C(C=CC(=C3)Cl)O)OC.[Cl-]

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)[NH2+]C3=C(C=CC(=C3)Cl)O)OC.[Cl-]

InChI

InChI=1S/C18H14ClN3O3.ClH/c1-24-16-6-12-13(7-17(16)25-2)21-9-10(8-20)18(12)22-14-5-11(19)3-4-15(14)23;/h3-7,9,23H,1-2H3,(H,21,22);1H