2-[4-[4-(1-oxidanyl-1-oxidanylidene-decan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonyldecanoic acid

Systemtic Name: 2-[4-[4-(1-oxidanyl-1-oxidanylidene-decan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonyldecanoic acid Openeye Name: 2-[4-[4-(1-carboxynonylsulfonyl)phenyl]sulfonylphenyl]sulfonyldecanoic acid CAS Name: 2-[4-[4-(1-hydroxy-1-oxodecan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonyldecanoic acid IUPAC Name: 2-[4-[4-(1-hydroxy-1-oxodecan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonyldecanoic acid Traditional Name: 2-[4-[4-(1-carboxynonylsulfonyl)phenyl]sulfonylphenyl]sulfonylcapric acid Formula: C32H46O10S3 MolecularWeight: 686.89664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C(CCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C(CCCCCCCC)C(=O)O

InChI

InChI=1S/C32H46O10S3/c1-3-5-7-9-11-13-15-29(31(33)34)44(39,40)27-21-17-25(18-22-27)43(37,38)26-19-23-28(24-20-26)45(41,42)30(32(35)36)16-14-12-10-8-6-4-2/h17-24,29-30H,3-16H2,1-2H3,(H,33,34)(H,35,36)