2-[(1S)-2,2,3-trimethylcyclopent-3-en-1-yl]ethanoylsulfanylmethyl ethanoate

Systemtic Name: 2-[(1S)-2,2,3-trimethylcyclopent-3-en-1-yl]ethanoylsulfanylmethyl ethanoate Openeye Name: [2-[(1S)-2,2,3-trimethylcyclopent-3-en-1-yl]acetyl]sulfanylmethyl acetate CAS Name: acetic acid [[1-oxo-2-[(1S)-2,2,3-trimethyl-1-cyclopent-3-enyl]ethyl]thio]methyl ester IUPAC Name: [2-[(1S)-2,2,3-trimethylcyclopent-3-en-1-yl]acetyl]sulfanylmethyl acetate Traditional Name: acetic acid [[2-[(1S)-2,2,3-trimethylcyclopent-3-en-1-yl]acetyl]thio]methyl ester Formula: C13H20O3S MolecularWeight: 256.3611

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C1(C)C)CC(=O)SCOC(=O)C

Isomeric SMILES

CC1=CC[C@H](C1(C)C)CC(=O)SCOC(=O)C

InChI

InChI=1S/C13H20O3S/c1-9-5-6-11(13(9,3)4)7-12(15)17-8-16-10(2)14/h5,11H,6-8H2,1-4H3/t11-/m0/s1