4-(2-chloranyl-6-oxidanyl-4-oxidanylidene-3-phenyl-7H-thieno[2,3-b]pyridin-5-yl)benzoic acid

Systemtic Name: 4-(2-chloranyl-6-oxidanyl-4-oxidanylidene-3-phenyl-7H-thieno[2,3-b]pyridin-5-yl)benzoic acid Openeye Name: 4-(2-chloro-6-hydroxy-4-oxo-3-phenyl-7H-thieno[2,3-b]pyridin-5-yl)benzoic acid CAS Name: 4-(2-chloro-6-hydroxy-4-oxo-3-phenyl-7H-thieno[2,3-b]pyridin-5-yl)benzoic acid IUPAC Name: 4-(2-chloro-6-hydroxy-4-oxo-3-phenyl-7H-thieno[2,3-b]pyridin-5-yl)benzoic acid Traditional Name: 4-(2-chloro-6-hydroxy-4-keto-3-phenyl-7H-thieno[2,3-b]pyridin-5-yl)benzoic acid Formula: C20H12ClNO4S MolecularWeight: 397.83158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC3=C2C(=O)C(=C(N3)O)C4=CC=C(C=C4)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC3=C2C(=O)C(=C(N3)O)C4=CC=C(C=C4)C(=O)O)Cl

InChI

InChI=1S/C20H12ClNO4S/c21-17-13(10-4-2-1-3-5-10)15-16(23)14(18(24)22-19(15)27-17)11-6-8-12(9-7-11)20(25)26/h1-9H,(H,25,26)(H2,22,23,24)