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

Systemtic Name: 4-(2-methoxy-2-oxidanylidene-ethyl)sulfanylbenzoic acid Openeye Name: 4-(2-methoxy-2-oxo-ethyl)sulfanylbenzoic acid CAS Name: 4-[(2-methoxy-2-oxoethyl)thio]benzoic acid IUPAC Name: 4-(2-methoxy-2-oxoethyl)sulfanylbenzoic acid Traditional Name: 4-[(2-keto-2-methoxy-ethyl)thio]benzoic acid Formula: C10H10O4S MolecularWeight: 226.249

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10O4S/c1-14-9(11)6-15-8-4-2-7(3-5-8)10(12)13/h2-5H,6H2,1H3,(H,12,13)