6-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-2-carboxylic acid

Systemtic Name: 6-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-2-carboxylic acid Openeye Name: 6-[2-(4-ethoxycarbonylanilino)-2-oxo-ethyl]sulfanylpyridine-2-carboxylic acid CAS Name: 6-[[2-(4-ethoxycarbonylanilino)-2-oxoethyl]thio]-2-pyridinecarboxylic acid IUPAC Name: 6-[2-(4-ethoxycarbonylanilino)-2-oxoethyl]sulfanylpyridine-2-carboxylic acid Traditional Name: 6-[[2-(4-carbethoxyanilino)-2-keto-ethyl]thio]picolinic acid Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5S/c1-2-24-17(23)11-6-8-12(9-7-11)18-14(20)10-25-15-5-3-4-13(19-15)16(21)22/h3-9H,2,10H2,1H3,(H,18,20)(H,21,22)