[3-oxidanyl-2-(9-oxidanyldecyl)-4-(phenylsulfonyl)phenyl] ethanoate

Systemtic Name: [3-oxidanyl-2-(9-oxidanyldecyl)-4-(phenylsulfonyl)phenyl] ethanoate Openeye Name: [4-(benzenesulfonyl)-3-hydroxy-2-(9-hydroxydecyl)phenyl] acetate CAS Name: acetic acid [4-(benzenesulfonyl)-3-hydroxy-2-(9-hydroxydecyl)phenyl] ester IUPAC Name: [4-(benzenesulfonyl)-3-hydroxy-2-(9-hydroxydecyl)phenyl] acetate Traditional Name: acetic acid [4-besyl-3-hydroxy-2-(9-hydroxydecyl)phenyl] ester Formula: C24H32O6S MolecularWeight: 448.57228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCC1=C(C=CC(=C1O)S(=O)(=O)C2=CC=CC=C2)OC(=O)C)O

Isomeric SMILES

CC(CCCCCCCCC1=C(C=CC(=C1O)S(=O)(=O)C2=CC=CC=C2)OC(=O)C)O

InChI

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