[1-(11-methanoyloxydodecyl)-6-oxidanylidene-5-(phenylsulfonyl)cyclohexa-2,4-dien-1-yl] ethanoate

Systemtic Name: [1-(11-methanoyloxydodecyl)-6-oxidanylidene-5-(phenylsulfonyl)cyclohexa-2,4-dien-1-yl] ethanoate Openeye Name: [5-(benzenesulfonyl)-1-(11-formyloxydodecyl)-6-oxo-cyclohexa-2,4-dien-1-yl] acetate CAS Name: acetic acid [5-(benzenesulfonyl)-1-(11-formyloxydodecyl)-6-oxo-1-cyclohexa-2,4-dienyl] ester IUPAC Name: [5-(benzenesulfonyl)-1-(11-formyloxydodecyl)-6-oxocyclohexa-2,4-dien-1-yl] acetate Traditional Name: acetic acid [5-besyl-1-(11-formyloxydodecyl)-6-keto-cyclohexa-2,4-dien-1-yl] ester Formula: C27H36O7S MolecularWeight: 504.63554

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCCCC1(C=CC=C(C1=O)S(=O)(=O)C2=CC=CC=C2)OC(=O)C)OC=O

Isomeric SMILES

CC(CCCCCCCCCCC1(C=CC=C(C1=O)S(=O)(=O)C2=CC=CC=C2)OC(=O)C)OC=O

InChI

InChI=1S/C27H36O7S/c1-22(33-21-28)15-10-7-5-3-4-6-8-13-19-27(34-23(2)29)20-14-18-25(26(27)30)35(31,32)24-16-11-9-12-17-24/h9,11-12,14,16-18,20-22H,3-8,10,13,15,19H2,1-2H3