[6-methyl-4-methylsulfonyl-3-oxidanyl-2-(9-oxidanyldecyl)phenyl] ethanoate

Systemtic Name: [6-methyl-4-methylsulfonyl-3-oxidanyl-2-(9-oxidanyldecyl)phenyl] ethanoate Openeye Name: [3-hydroxy-2-(9-hydroxydecyl)-6-methyl-4-methylsulfonyl-phenyl] acetate CAS Name: acetic acid [3-hydroxy-2-(9-hydroxydecyl)-6-methyl-4-methylsulfonylphenyl] ester IUPAC Name: [3-hydroxy-2-(9-hydroxydecyl)-6-methyl-4-methylsulfonylphenyl] acetate Traditional Name: acetic acid [3-hydroxy-2-(9-hydroxydecyl)-4-mesyl-6-methyl-phenyl] ester Formula: C20H32O6S MolecularWeight: 400.52948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1OC(=O)C)CCCCCCCCC(C)O)O)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C(=C1OC(=O)C)CCCCCCCCC(C)O)O)S(=O)(=O)C

InChI

InChI=1S/C20H32O6S/c1-14-13-18(27(4,24)25)19(23)17(20(14)26-16(3)22)12-10-8-6-5-7-9-11-15(2)21/h13,15,21,23H,5-12H2,1-4H3