acetyloxymethyl 7-(ethanethioylamino)-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: acetyloxymethyl 7-(ethanethioylamino)-2-oxidanylidene-chromene-3-carboxylate Openeye Name: acetoxymethyl 7-(ethanethioylamino)-2-oxo-chromene-3-carboxylate CAS Name: 2-oxo-7-(1-sulfanylideneethylamino)-1-benzopyran-3-carboxylic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl 7-(ethanethioylamino)-2-oxochromene-3-carboxylate Traditional Name: 2-keto-7-(thioacetylamino)chromene-3-carboxylic acid acetoxymethyl ester Formula: C15H13NO6S MolecularWeight: 335.33182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCOC(=O)C

Isomeric SMILES

CC(=S)NC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCOC(=O)C

InChI

InChI=1S/C15H13NO6S/c1-8(23)16-11-4-3-10-5-12(15(19)22-13(10)6-11)14(18)21-7-20-9(2)17/h3-6H,7H2,1-2H3,(H,16,23)