[(Z)-5,5-bis(phenylsulfonyl)oct-2-en-7-ynyl] ethanoate

Systemtic Name: [(Z)-5,5-bis(phenylsulfonyl)oct-2-en-7-ynyl] ethanoate Openeye Name: [(Z)-5,5-bis(benzenesulfonyl)oct-2-en-7-ynyl] acetate CAS Name: acetic acid [(Z)-5,5-bis(benzenesulfonyl)oct-2-en-7-ynyl] ester IUPAC Name: [(Z)-5,5-bis(benzenesulfonyl)oct-2-en-7-ynyl] acetate Traditional Name: acetic acid [(Z)-5,5-dibesyloct-2-en-7-ynyl] ester Formula: C22H22O6S2 MolecularWeight: 446.53648

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC=CCC(CC#C)(S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)OC/C=C\CC(CC#C)(S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H22O6S2/c1-3-16-22(17-10-11-18-28-19(2)23,29(24,25)20-12-6-4-7-13-20)30(26,27)21-14-8-5-9-15-21/h1,4-15H,16-18H2,2H3/b11-10-