[(E,3S)-5-methyl-1-(4-methylphenyl)sulfonyl-hex-1-en-3-yl] ethanoate

Systemtic Name: [(E,3S)-5-methyl-1-(4-methylphenyl)sulfonyl-hex-1-en-3-yl] ethanoate Openeye Name: [(1S)-3-methyl-1-[(E)-2-(p-tolylsulfonyl)vinyl]butyl] acetate CAS Name: acetic acid [(E,3S)-5-methyl-1-(4-methylphenyl)sulfonylhex-1-en-3-yl] ester IUPAC Name: [(E,3S)-5-methyl-1-(4-methylphenyl)sulfonylhex-1-en-3-yl] acetate Traditional Name: acetic acid [(E,1S)-1-isobutyl-3-tosyl-allyl] ester Formula: C16H22O4S MolecularWeight: 310.40848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O4S/c1-12(2)11-15(20-14(4)17)9-10-21(18,19)16-7-5-13(3)6-8-16/h5-10,12,15H,11H2,1-4H3/b10-9+/t15-/m1/s1