methyl 3,5-didodecyl-4-methyl-benzenesulfonate

Systemtic Name: methyl 3,5-didodecyl-4-methyl-benzenesulfonate Openeye Name: methyl 3,5-didodecyl-4-methyl-benzenesulfonate CAS Name: 3,5-didodecyl-4-methylbenzenesulfonic acid methyl ester IUPAC Name: methyl 3,5-didodecyl-4-methylbenzenesulfonate Traditional Name: 3,5-dilauryl-4-methyl-benzenesulfonic acid methyl ester Formula: C32H58O3S MolecularWeight: 522.86612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=CC(=C1C)CCCCCCCCCCCC)S(=O)(=O)OC

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=CC(=C1C)CCCCCCCCCCCC)S(=O)(=O)OC

InChI

InChI=1S/C32H58O3S/c1-5-7-9-11-13-15-17-19-21-23-25-30-27-32(36(33,34)35-4)28-31(29(30)3)26-24-22-20-18-16-14-12-10-8-6-2/h27-28H,5-26H2,1-4H3