[(1S,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-oxidanylidene-2-thiophen-2-yl-ethanoate

Systemtic Name: [(1S,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-oxidanylidene-2-thiophen-2-yl-ethanoate Openeye Name: [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-oxo-2-(2-thienyl)acetate CAS Name: 2-oxo-2-thiophen-2-ylacetic acid [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-oxo-2-thiophen-2-ylacetate Traditional Name: 2-keto-2-(2-thienyl)acetic acid [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C16H22O3S MolecularWeight: 294.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(=O)C2=CC=CS2)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@H](C1)OC(=O)C(=O)C2=CC=CS2)C(C)C

InChI

InChI=1S/C16H22O3S/c1-10(2)12-7-6-11(3)9-13(12)19-16(18)15(17)14-5-4-8-20-14/h4-5,8,10-13H,6-7,9H2,1-3H3/t11-,12+,13+/m1/s1