[(1R)-2-tert-butylsulfinyl-1-(1-methylcyclohexa-2,5-dien-1-yl)ethyl] ethanoate

Systemtic Name: [(1R)-2-tert-butylsulfinyl-1-(1-methylcyclohexa-2,5-dien-1-yl)ethyl] ethanoate Openeye Name: [(1R)-2-tert-butylsulfinyl-1-(1-methylcyclohexa-2,5-dien-1-yl)ethyl] acetate CAS Name: acetic acid [(1R)-2-tert-butylsulfinyl-1-(1-methyl-1-cyclohexa-2,5-dienyl)ethyl] ester IUPAC Name: [(1R)-2-tert-butylsulfinyl-1-(1-methylcyclohexa-2,5-dien-1-yl)ethyl] acetate Traditional Name: acetic acid [(1R)-2-tert-butylsulfinyl-1-(1-methylcyclohexa-2,5-dien-1-yl)ethyl] ester Formula: C15H24O3S MolecularWeight: 284.41426

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CS(=O)C(C)(C)C)C1(C=CCC=C1)C

Isomeric SMILES

CC(=O)O[C@@H](CS(=O)C(C)(C)C)C1(C=CCC=C1)C

InChI

InChI=1S/C15H24O3S/c1-12(16)18-13(11-19(17)14(2,3)4)15(5)9-7-6-8-10-15/h7-10,13H,6,11H2,1-5H3/t13-,19?/m0/s1