2-[(4S)-4-ethyl-6-oxidanylidene-cyclohexen-1-yl]sulfanylethanoic acid

Systemtic Name: 2-[(4S)-4-ethyl-6-oxidanylidene-cyclohexen-1-yl]sulfanylethanoic acid Openeye Name: 2-[(4S)-4-ethyl-6-oxo-cyclohexen-1-yl]sulfanylacetic acid CAS Name: 2-[[(4S)-4-ethyl-6-oxo-1-cyclohexenyl]thio]acetic acid IUPAC Name: 2-[(4S)-4-ethyl-6-oxocyclohexen-1-yl]sulfanylacetic acid Traditional Name: 2-[[(4S)-4-ethyl-6-keto-cyclohexen-1-yl]thio]acetic acid Formula: C10H14O3S MolecularWeight: 214.28136

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC=C(C(=O)C1)SCC(=O)O

Isomeric SMILES

CC[C@H]1CC=C(C(=O)C1)SCC(=O)O

InChI

InChI=1S/C10H14O3S/c1-2-7-3-4-9(8(11)5-7)14-6-10(12)13/h4,7H,2-3,5-6H2,1H3,(H,12,13)/t7-/m0/s1