[(E,2R)-4-[(R)-(4-methylphenyl)sulfinyl]but-3-en-2-yl] ethanoate

Systemtic Name: [(E,2R)-4-[(R)-(4-methylphenyl)sulfinyl]but-3-en-2-yl] ethanoate Openeye Name: [(E,1R)-1-methyl-3-[(R)-p-tolylsulfinyl]allyl] acetate CAS Name: acetic acid [(E,2R)-4-[(R)-(4-methylphenyl)sulfinyl]but-3-en-2-yl] ester IUPAC Name: [(E,2R)-4-[(R)-(4-methylphenyl)sulfinyl]but-3-en-2-yl] acetate Traditional Name: acetic acid [(E,1R)-1-methyl-3-[(R)-p-tolylsulfinyl]allyl] ester Formula: C13H16O3S MolecularWeight: 252.32934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C=CC(C)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)/C=C/[C@@H](C)OC(=O)C

InChI

InChI=1S/C13H16O3S/c1-10-4-6-13(7-5-10)17(15)9-8-11(2)16-12(3)14/h4-9,11H,1-3H3/b9-8+/t11-,17-/m1/s1