5-fluorosulfonyl-2-hexadecylsulfonyl-benzoic acid

Systemtic Name: 5-fluorosulfonyl-2-hexadecylsulfonyl-benzoic acid Openeye Name: 5-fluorosulfonyl-2-hexadecylsulfonyl-benzoic acid CAS Name: 5-fluorosulfonyl-2-hexadecylsulfonylbenzoic acid IUPAC Name: 5-fluorosulfonyl-2-hexadecylsulfonylbenzoic acid Traditional Name: 2-cetylsulfonyl-5-fluorosulfonyl-benzoic acid Formula: C23H37FO6S2 MolecularWeight: 492.664683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCS(=O)(=O)C1=C(C=C(C=C1)S(=O)(=O)F)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCS(=O)(=O)C1=C(C=C(C=C1)S(=O)(=O)F)C(=O)O

InChI

InChI=1S/C23H37FO6S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-31(27,28)22-17-16-20(32(24,29)30)19-21(22)23(25)26/h16-17,19H,2-15,18H2,1H3,(H,25,26)