3-oxidanylidene-2-[2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethyl]butanethioic S-acid

Systemtic Name: 3-oxidanylidene-2-[2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethyl]butanethioic S-acid Openeye Name: 3-oxo-2-[2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethyl]butanethioic S-acid CAS Name: 3-oxo-2-[2-(2,6,6-trimethyl-1-cyclohex-2-enyl)ethyl]butanethioic S-acid IUPAC Name: 3-oxo-2-[2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethyl]butanethioic S-acid Traditional Name: 3-keto-2-[2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethyl]thiobutyric acid Formula: C15H24O2S MolecularWeight: 268.41486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCCC(C1CCC(C(=O)C)C(=O)S)(C)C

Isomeric SMILES

CC1=CCCC(C1CCC(C(=O)C)C(=O)S)(C)C

InChI

InChI=1S/C15H24O2S/c1-10-6-5-9-15(3,4)13(10)8-7-12(11(2)16)14(17)18/h6,12-13H,5,7-9H2,1-4H3,(H,17,18)