[6-oxidanylidene-1-(17-oxidanyloctadecyl)-5-(phenylsulfonyl)cyclohexa-2,4-dien-1-yl] ethanoate

Systemtic Name: [6-oxidanylidene-1-(17-oxidanyloctadecyl)-5-(phenylsulfonyl)cyclohexa-2,4-dien-1-yl] ethanoate Openeye Name: [5-(benzenesulfonyl)-1-(17-hydroxyoctadecyl)-6-oxo-cyclohexa-2,4-dien-1-yl] acetate CAS Name: acetic acid [5-(benzenesulfonyl)-1-(17-hydroxyoctadecyl)-6-oxo-1-cyclohexa-2,4-dienyl] ester IUPAC Name: [5-(benzenesulfonyl)-1-(17-hydroxyoctadecyl)-6-oxocyclohexa-2,4-dien-1-yl] acetate Traditional Name: acetic acid [5-besyl-1-(17-hydroxyoctadecyl)-6-keto-cyclohexa-2,4-dien-1-yl] ester Formula: C32H48O6S MolecularWeight: 560.78492

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCCCCCCCCCC1(C=CC=C(C1=O)S(=O)(=O)C2=CC=CC=C2)OC(=O)C)O

Isomeric SMILES

CC(CCCCCCCCCCCCCCCCC1(C=CC=C(C1=O)S(=O)(=O)C2=CC=CC=C2)OC(=O)C)O

InChI

InChI=1S/C32H48O6S/c1-27(33)21-16-13-11-9-7-5-3-4-6-8-10-12-14-19-25-32(38-28(2)34)26-20-24-30(31(32)35)39(36,37)29-22-17-15-18-23-29/h15,17-18,20,22-24,26-27,33H,3-14,16,19,21,25H2,1-2H3