2-[2-[(2-carboxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-[(2-carboxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-(2-carboxyanilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-(2-carboxyanilino)-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(2-carboxyanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-(2-carboxyanilino)-2-keto-ethyl]thio]nicotinic acid Formula: C15H12N2O5S MolecularWeight: 332.33118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C15H12N2O5S/c18-12(17-11-6-2-1-4-9(11)14(19)20)8-23-13-10(15(21)22)5-3-7-16-13/h1-7H,8H2,(H,17,18)(H,19,20)(H,21,22)