4-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylbenzoic acid

Systemtic Name: 4-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylbenzoic acid Openeye Name: 4-(2-ethoxy-2-oxo-ethyl)sulfanylbenzoic acid CAS Name: 4-[(2-ethoxy-2-oxoethyl)thio]benzoic acid IUPAC Name: 4-(2-ethoxy-2-oxoethyl)sulfanylbenzoic acid Traditional Name: 4-[(2-ethoxy-2-keto-ethyl)thio]benzoic acid Formula: C11H12O4S MolecularWeight: 240.27558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O4S/c1-2-15-10(12)7-16-9-5-3-8(4-6-9)11(13)14/h3-6H,2,7H2,1H3,(H,13,14)