4-[(5-chloranyl-2-oxidanyl-phenyl)amino]quinoline-3,6-dicarboxylic acid hydrochloride

Systemtic Name: 4-[(5-chloranyl-2-oxidanyl-phenyl)amino]quinoline-3,6-dicarboxylic acid hydrochloride Openeye Name: 4-(5-chloro-2-hydroxy-anilino)quinoline-3,6-dicarboxylic acid hydrochloride CAS Name: 4-(5-chloro-2-hydroxyanilino)quinoline-3,6-dicarboxylic acid hydrochloride IUPAC Name: 4-(5-chloro-2-hydroxyanilino)quinoline-3,6-dicarboxylic acid hydrochloride Traditional Name: 4-(5-chloro-2-hydroxy-anilino)quinoline-3,6-dicarboxylic acid hydrochloride Formula: C17H12Cl2N2O5 MolecularWeight: 395.19358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC=C(C(=C2C=C1C(=O)O)NC3=C(C=CC(=C3)Cl)O)C(=O)O.Cl

Isomeric SMILES

C1=CC2=NC=C(C(=C2C=C1C(=O)O)NC3=C(C=CC(=C3)Cl)O)C(=O)O.Cl

InChI

InChI=1S/C17H11ClN2O5.ClH/c18-9-2-4-14(21)13(6-9)20-15-10-5-8(16(22)23)1-3-12(10)19-7-11(15)17(24)25;/h1-7,21H,(H,19,20)(H,22,23)(H,24,25);1H