2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylpyridine-4-carboxylic acid

Systemtic Name: 2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylpyridine-4-carboxylic acid Openeye Name: 2-(2-ethoxy-2-oxo-ethyl)sulfanylpyridine-4-carboxylic acid CAS Name: 2-[(2-ethoxy-2-oxoethyl)thio]-4-pyridinecarboxylic acid IUPAC Name: 2-(2-ethoxy-2-oxoethyl)sulfanylpyridine-4-carboxylic acid Traditional Name: 2-[(2-ethoxy-2-keto-ethyl)thio]isonicotinic acid Formula: C10H11NO4S MolecularWeight: 241.26364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC=CC(=C1)C(=O)O

Isomeric SMILES

CCOC(=O)CSC1=NC=CC(=C1)C(=O)O

InChI

InChI=1S/C10H11NO4S/c1-2-15-9(12)6-16-8-5-7(10(13)14)3-4-11-8/h3-5H,2,6H2,1H3,(H,13,14)