10-methylundecyl 1-(2-methylphenyl)propane-1-sulfonate

Systemtic Name: 10-methylundecyl 1-(2-methylphenyl)propane-1-sulfonate Openeye Name: 10-methylundecyl 1-(o-tolyl)propane-1-sulfonate CAS Name: 1-(2-methylphenyl)-1-propanesulfonic acid IUPAC Name: 10-methylundecyl 1-(2-methylphenyl)propane-1-sulfonate Traditional Name: 1-(o-tolyl)propane-1-sulfonic acid 10-methylundecyl ester Formula: C22H38O3S MolecularWeight: 382.60032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1C)S(=O)(=O)OCCCCCCCCCC(C)C

Isomeric SMILES

CCC(C1=CC=CC=C1C)S(=O)(=O)OCCCCCCCCCC(C)C

InChI

InChI=1S/C22H38O3S/c1-5-22(21-17-13-12-16-20(21)4)26(23,24)25-18-14-10-8-6-7-9-11-15-19(2)3/h12-13,16-17,19,22H,5-11,14-15,18H2,1-4H3