2-(4-methylphenyl)sulfonylhexadecanoic acid

Systemtic Name: 2-(4-methylphenyl)sulfonylhexadecanoic acid Openeye Name: 2-(p-tolylsulfonyl)hexadecanoic acid CAS Name: 2-(4-methylphenyl)sulfonylhexadecanoic acid IUPAC Name: 2-(4-methylphenyl)sulfonylhexadecanoic acid Traditional Name: 2-tosylpalmitic acid Formula: C23H38O4S MolecularWeight: 410.61042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCCCCCCCCC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C23H38O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22(23(24)25)28(26,27)21-18-16-20(2)17-19-21/h16-19,22H,3-15H2,1-2H3,(H,24,25)