[(E,3R)-1-(phenylsulfonyl)hept-1-en-6-yn-3-yl] ethanoate

Systemtic Name: [(E,3R)-1-(phenylsulfonyl)hept-1-en-6-yn-3-yl] ethanoate Openeye Name: [(1R)-1-[(E)-2-(benzenesulfonyl)vinyl]pent-4-ynyl] acetate CAS Name: acetic acid [(E,3R)-1-(benzenesulfonyl)hept-1-en-6-yn-3-yl] ester IUPAC Name: [(E,3R)-1-(benzenesulfonyl)hept-1-en-6-yn-3-yl] acetate Traditional Name: acetic acid [(1R)-1-[(E)-2-besylvinyl]pent-4-ynyl] ester Formula: C15H16O4S MolecularWeight: 292.35014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)O[C@H](CCC#C)/C=C/S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H16O4S/c1-3-4-8-14(19-13(2)16)11-12-20(17,18)15-9-6-5-7-10-15/h1,5-7,9-12,14H,4,8H2,2H3/b12-11+/t14-/m1/s1