5-methyl-3-[(4-methylphenyl)sulfonyloxymethyl]decanoic acid

Systemtic Name: 5-methyl-3-[(4-methylphenyl)sulfonyloxymethyl]decanoic acid Openeye Name: 5-methyl-3-(p-tolylsulfonyloxymethyl)decanoic acid CAS Name: 5-methyl-3-[(4-methylphenyl)sulfonyloxymethyl]decanoic acid IUPAC Name: 5-methyl-3-[(4-methylphenyl)sulfonyloxymethyl]decanoic acid Traditional Name: 5-methyl-3-(tosyloxymethyl)capric acid Formula: C19H30O5S MolecularWeight: 370.5035

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CC(CC(=O)O)COS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCC(C)CC(CC(=O)O)COS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C19H30O5S/c1-4-5-6-7-16(3)12-17(13-19(20)21)14-24-25(22,23)18-10-8-15(2)9-11-18/h8-11,16-17H,4-7,12-14H2,1-3H3,(H,20,21)