2-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-6-oxidanylidene-cyclohexen-1-yl]ethanoic acid

Systemtic Name: 2-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-6-oxidanylidene-cyclohexen-1-yl]ethanoic acid Openeye Name: 2-[2-(2-ethoxy-2-oxo-ethyl)sulfanyl-6-oxo-cyclohexen-1-yl]acetic acid CAS Name: 2-[2-[(2-ethoxy-2-oxoethyl)thio]-6-oxo-1-cyclohexenyl]acetic acid IUPAC Name: 2-[2-(2-ethoxy-2-oxoethyl)sulfanyl-6-oxocyclohexen-1-yl]acetic acid Traditional Name: 2-[2-[(2-ethoxy-2-keto-ethyl)thio]-6-keto-cyclohexen-1-yl]acetic acid Formula: C12H16O5S MolecularWeight: 272.31744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(=O)CCC1)CC(=O)O

Isomeric SMILES

CCOC(=O)CSC1=C(C(=O)CCC1)CC(=O)O

InChI

InChI=1S/C12H16O5S/c1-2-17-12(16)7-18-10-5-3-4-9(13)8(10)6-11(14)15/h2-7H2,1H3,(H,14,15)