(4-methylphenyl)sulfonyl-(2-tetradecylphenyl)methanesulfonic acid

Systemtic Name: (4-methylphenyl)sulfonyl-(2-tetradecylphenyl)methanesulfonic acid Openeye Name: p-tolylsulfonyl-(2-tetradecylphenyl)methanesulfonic acid CAS Name: (4-methylphenyl)sulfonyl-(2-tetradecylphenyl)methanesulfonic acid IUPAC Name: (4-methylphenyl)sulfonyl-(2-tetradecylphenyl)methanesulfonic acid Traditional Name: (2-myristylphenyl)-tosyl-methanesulfonic acid Formula: C28H42O5S2 MolecularWeight: 522.76008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC=CC=C1C(S(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC=CC=C1C(S(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)O

InChI

InChI=1S/C28H42O5S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-25-18-15-16-19-27(25)28(35(31,32)33)34(29,30)26-22-20-24(2)21-23-26/h15-16,18-23,28H,3-14,17H2,1-2H3,(H,31,32,33)