2,3-bis(10-methylundecyl)benzenesulfonic acid

Systemtic Name: 2,3-bis(10-methylundecyl)benzenesulfonic acid Openeye Name: 2,3-bis(10-methylundecyl)benzenesulfonic acid CAS Name: 2,3-bis(10-methylundecyl)benzenesulfonic acid IUPAC Name: 2,3-bis(10-methylundecyl)benzenesulfonic acid Traditional Name: 2,3-bis(10-methylundecyl)besylic acid Formula: C30H54O3S MolecularWeight: 494.81296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCC1=C(C(=CC=C1)S(=O)(=O)O)CCCCCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCCCCCC1=C(C(=CC=C1)S(=O)(=O)O)CCCCCCCCCC(C)C

InChI

InChI=1S/C30H54O3S/c1-26(2)20-15-11-7-5-9-13-17-22-28-23-19-25-30(34(31,32)33)29(28)24-18-14-10-6-8-12-16-21-27(3)4/h19,23,25-27H,5-18,20-22,24H2,1-4H3,(H,31,32,33)