[1-(9-oxidanyldecyl)-6-oxidanylidene-5-(phenylsulfonyl)cyclohexa-2,4-dien-1-yl] ethanoate

Systemtic Name: [1-(9-oxidanyldecyl)-6-oxidanylidene-5-(phenylsulfonyl)cyclohexa-2,4-dien-1-yl] ethanoate Openeye Name: [5-(benzenesulfonyl)-1-(9-hydroxydecyl)-6-oxo-cyclohexa-2,4-dien-1-yl] acetate CAS Name: acetic acid [5-(benzenesulfonyl)-1-(9-hydroxydecyl)-6-oxo-1-cyclohexa-2,4-dienyl] ester IUPAC Name: [5-(benzenesulfonyl)-1-(9-hydroxydecyl)-6-oxocyclohexa-2,4-dien-1-yl] acetate Traditional Name: acetic acid [5-besyl-1-(9-hydroxydecyl)-6-keto-cyclohexa-2,4-dien-1-yl] ester Formula: C24H32O6S MolecularWeight: 448.57228

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCC1(C=CC=C(C1=O)S(=O)(=O)C2=CC=CC=C2)OC(=O)C)O

Isomeric SMILES

CC(CCCCCCCCC1(C=CC=C(C1=O)S(=O)(=O)C2=CC=CC=C2)OC(=O)C)O

InChI

InChI=1S/C24H32O6S/c1-19(25)13-8-5-3-4-6-11-17-24(30-20(2)26)18-12-16-22(23(24)27)31(28,29)21-14-9-7-10-15-21/h7,9-10,12,14-16,18-19,25H,3-6,8,11,13,17H2,1-2H3