2-[4-[4-(1-oxidanyl-1-oxidanylidene-dodecan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonyldodecanoic acid

Systemtic Name: 2-[4-[4-(1-oxidanyl-1-oxidanylidene-dodecan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonyldodecanoic acid Openeye Name: 2-[4-[4-(1-carboxyundecylsulfonyl)phenyl]sulfonylphenyl]sulfonyldodecanoic acid CAS Name: 2-[4-[4-(1-hydroxy-1-oxododecan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonyldodecanoic acid IUPAC Name: 2-[4-[4-(1-hydroxy-1-oxododecan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonyldodecanoic acid Traditional Name: 2-[4-[4-(1-carboxyundecylsulfonyl)phenyl]sulfonylphenyl]sulfonyllauric acid Formula: C36H54O10S3 MolecularWeight: 743.00296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C(CCCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C(CCCCCCCCCC)C(=O)O

InChI

InChI=1S/C36H54O10S3/c1-3-5-7-9-11-13-15-17-19-33(35(37)38)48(43,44)31-25-21-29(22-26-31)47(41,42)30-23-27-32(28-24-30)49(45,46)34(36(39)40)20-18-16-14-12-10-8-6-4-2/h21-28,33-34H,3-20H2,1-2H3,(H,37,38)(H,39,40)