6-methoxy-4-[(3-nitrophenyl)amino]quinoline-3-carboxylic acid hydrochloride

Systemtic Name: 6-methoxy-4-[(3-nitrophenyl)amino]quinoline-3-carboxylic acid hydrochloride Openeye Name: 6-methoxy-4-(3-nitroanilino)quinoline-3-carboxylic acid hydrochloride CAS Name: 6-methoxy-4-(3-nitroanilino)-3-quinolinecarboxylic acid hydrochloride IUPAC Name: 6-methoxy-4-(3-nitroanilino)quinoline-3-carboxylic acid hydrochloride Traditional Name: 6-methoxy-4-(3-nitroanilino)quinoline-3-carboxylic acid hydrochloride Formula: C17H14ClN3O5 MolecularWeight: 375.76316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CN=C2C=C1)C(=O)O)NC3=CC(=CC=C3)[N+](=O)[O-].Cl

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)C(=O)O)NC3=CC(=CC=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C17H13N3O5.ClH/c1-25-12-5-6-15-13(8-12)16(14(9-18-15)17(21)22)19-10-3-2-4-11(7-10)20(23)24;/h2-9H,1H3,(H,18,19)(H,21,22);1H