2-[2-[(4E)-4-(ethoxymethylidene)-5-oxidanylidene-1,3-oxazol-2-yl]phenyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[(4E)-4-(ethoxymethylidene)-5-oxidanylidene-1,3-oxazol-2-yl]phenyl]sulfanylethanoic acid Openeye Name: 2-[2-[(4E)-4-(ethoxymethylene)-5-oxo-oxazol-2-yl]phenyl]sulfanylacetic acid CAS Name: 2-[[2-[(4E)-4-(ethoxymethylidene)-5-oxo-2-oxazolyl]phenyl]thio]acetic acid IUPAC Name: 2-[2-[(4E)-4-(ethoxymethylidene)-5-oxo-1,3-oxazol-2-yl]phenyl]sulfanylacetic acid Traditional Name: 2-[[2-[(4E)-4-(ethoxymethylene)-5-keto-2-oxazolin-2-yl]phenyl]thio]acetic acid Formula: C14H13NO5S MolecularWeight: 307.32172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=C1C(=O)OC(=N1)C2=CC=CC=C2SCC(=O)O

Isomeric SMILES

CCO/C=C/1\C(=O)OC(=N1)C2=CC=CC=C2SCC(=O)O

InChI

InChI=1S/C14H13NO5S/c1-2-19-7-10-14(18)20-13(15-10)9-5-3-4-6-11(9)21-8-12(16)17/h3-7H,2,8H2,1H3,(H,16,17)/b10-7+