2-[(7-chloranyl-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl)sulfanyl]benzoic acid

Systemtic Name: 2-[(7-chloranyl-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl)sulfanyl]benzoic acid Openeye Name: 2-[(7-chloro-2-hydroxy-4-oxo-1H-quinolin-3-yl)sulfanyl]benzoic acid CAS Name: 2-[(7-chloro-2-hydroxy-4-oxo-1H-quinolin-3-yl)thio]benzoic acid IUPAC Name: 2-[(7-chloro-2-hydroxy-4-oxo-1H-quinolin-3-yl)sulfanyl]benzoic acid Traditional Name: 2-[(7-chloro-2-hydroxy-4-keto-1H-quinolin-3-yl)thio]benzoic acid Formula: C16H10ClNO4S MolecularWeight: 347.7729

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)SC2=C(NC3=C(C2=O)C=CC(=C3)Cl)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)SC2=C(NC3=C(C2=O)C=CC(=C3)Cl)O

InChI

InChI=1S/C16H10ClNO4S/c17-8-5-6-9-11(7-8)18-15(20)14(13(9)19)23-12-4-2-1-3-10(12)16(21)22/h1-7H,(H,21,22)(H2,18,19,20)