2-butyl-3-(10-methylundecyl)benzenesulfonate

Systemtic Name: 2-butyl-3-(10-methylundecyl)benzenesulfonate Openeye Name: 2-butyl-3-(10-methylundecyl)benzenesulfonate CAS Name: 2-butyl-3-(10-methylundecyl)benzenesulfonate IUPAC Name: 2-butyl-3-(10-methylundecyl)benzenesulfonate Traditional Name: 2-butyl-3-(10-methylundecyl)besylate Formula: C22H37O3S- MolecularWeight: 381.59238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC=C1S(=O)(=O)[O-])CCCCCCCCCC(C)C

Isomeric SMILES

CCCCC1=C(C=CC=C1S(=O)(=O)[O-])CCCCCCCCCC(C)C

InChI

InChI=1S/C22H38O3S/c1-4-5-17-21-20(16-13-18-22(21)26(23,24)25)15-12-10-8-6-7-9-11-14-19(2)3/h13,16,18-19H,4-12,14-15,17H2,1-3H3,(H,23,24,25)/p-1