6-oxidanyl-11-phenyl-heptadecane-3-sulfonic acid

Systemtic Name: 6-oxidanyl-11-phenyl-heptadecane-3-sulfonic acid Openeye Name: 6-hydroxy-11-phenyl-heptadecane-3-sulfonic acid CAS Name: 6-hydroxy-11-phenyl-3-heptadecanesulfonic acid IUPAC Name: 6-hydroxy-11-phenylheptadecane-3-sulfonic acid Traditional Name: 6-hydroxy-11-phenyl-heptadecane-3-sulfonic acid Formula: C23H40O4S MolecularWeight: 412.6263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCC(CCC(CC)S(=O)(=O)O)O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCC(CCCCC(CCC(CC)S(=O)(=O)O)O)C1=CC=CC=C1

InChI

InChI=1S/C23H40O4S/c1-3-5-6-8-13-21(20-14-9-7-10-15-20)16-11-12-17-22(24)18-19-23(4-2)28(25,26)27/h7,9-10,14-15,21-24H,3-6,8,11-13,16-19H2,1-2H3,(H,25,26,27)