S-[4-oxidanylidene-4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)butan-2-yl] ethanethioate

Systemtic Name: S-[4-oxidanylidene-4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)butan-2-yl] ethanethioate Openeye Name: S-[1-methyl-3-oxo-3-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)propyl] ethanethioate CAS Name: ethanethioic acid S-[4-oxo-4-(2,6,6-trimethyl-1-cyclohexa-1,3-dienyl)butan-2-yl] ester IUPAC Name: S-[4-oxo-4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)butan-2-yl] ethanethioate Traditional Name: ethanethioic acid S-[3-keto-1-methyl-3-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)propyl] ester Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC=C1)(C)C)C(=O)CC(C)SC(=O)C

Isomeric SMILES

CC1=C(C(CC=C1)(C)C)C(=O)CC(C)SC(=O)C

InChI

InChI=1S/C15H22O2S/c1-10-7-6-8-15(4,5)14(10)13(17)9-11(2)18-12(3)16/h6-7,11H,8-9H2,1-5H3