(2-hexylphenyl)-(2-nonylphenyl)methanesulfonic acid

Systemtic Name: (2-hexylphenyl)-(2-nonylphenyl)methanesulfonic acid Openeye Name: (2-hexylphenyl)-(2-nonylphenyl)methanesulfonic acid CAS Name: (2-hexylphenyl)-(2-nonylphenyl)methanesulfonic acid IUPAC Name: (2-hexylphenyl)-(2-nonylphenyl)methanesulfonic acid Traditional Name: (2-hexylphenyl)-(2-nonylphenyl)methanesulfonic acid Formula: C28H42O3S MolecularWeight: 458.69628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=CC=C1C(C2=CC=CC=C2CCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC1=CC=CC=C1C(C2=CC=CC=C2CCCCCC)S(=O)(=O)O

InChI

InChI=1S/C28H42O3S/c1-3-5-7-9-10-11-13-19-25-21-15-17-23-27(25)28(32(29,30)31)26-22-16-14-20-24(26)18-12-8-6-4-2/h14-17,20-23,28H,3-13,18-19H2,1-2H3,(H,29,30,31)