3-azanyl-2-(4-methoxyphenyl)carbonyl-6-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylic acid hydrochloride

Systemtic Name: 3-azanyl-2-(4-methoxyphenyl)carbonyl-6-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylic acid hydrochloride Openeye Name: 3-amino-2-(4-methoxybenzoyl)-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid hydrochloride CAS Name: 3-amino-2-[(4-methoxyphenyl)-oxomethyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid hydrochloride IUPAC Name: 3-amino-2-(4-methoxybenzoyl)-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid hydrochloride Traditional Name: 3-amino-6-keto-2-p-anisoyl-7H-thieno[2,3-b]pyridine-5-carboxylic acid hydrochloride Formula: C16H13ClN2O5S MolecularWeight: 380.80282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)O)N.Cl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)O)N.Cl

InChI

InChI=1S/C16H12N2O5S.ClH/c1-23-8-4-2-7(3-5-8)12(19)13-11(17)9-6-10(16(21)22)14(20)18-15(9)24-13;/h2-6H,17H2,1H3,(H,18,20)(H,21,22);1H