[2-[(4-methylphenyl)sulfonyloxymethyl]-4-oxidanyl-butyl] octadecanoate

Systemtic Name: [2-[(4-methylphenyl)sulfonyloxymethyl]-4-oxidanyl-butyl] octadecanoate Openeye Name: [4-hydroxy-2-(p-tolylsulfonyloxymethyl)butyl] octadecanoate CAS Name: octadecanoic acid [4-hydroxy-2-[(4-methylphenyl)sulfonyloxymethyl]butyl] ester IUPAC Name: [4-hydroxy-2-[(4-methylphenyl)sulfonyloxymethyl]butyl] octadecanoate Traditional Name: stearic acid [4-hydroxy-2-(tosyloxymethyl)butyl] ester Formula: C30H52O6S MolecularWeight: 540.79528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(CCO)COS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(CCO)COS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C30H52O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-30(32)35-25-28(23-24-31)26-36-37(33,34)29-21-19-27(2)20-22-29/h19-22,28,31H,3-18,23-26H2,1-2H3