2-[4-[4-(1-oxidanyl-1-oxidanylidene-hexan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonylhexanoic acid

Systemtic Name: 2-[4-[4-(1-oxidanyl-1-oxidanylidene-hexan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonylhexanoic acid Openeye Name: 2-[4-[4-(1-carboxypentylsulfonyl)phenyl]sulfonylphenyl]sulfonylhexanoic acid CAS Name: 2-[4-[4-(1-hydroxy-1-oxohexan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonylhexanoic acid IUPAC Name: 2-[4-[4-(1-hydroxy-1-oxohexan-2-yl)sulfonylphenyl]sulfonylphenyl]sulfonylhexanoic acid Traditional Name: 2-[4-[4-(1-carboxypentylsulfonyl)phenyl]sulfonylphenyl]sulfonylhexanoic acid Formula: C24H30O10S3 MolecularWeight: 574.684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C(CCCC)C(=O)O

Isomeric SMILES

CCCCC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C(CCCC)C(=O)O

InChI

InChI=1S/C24H30O10S3/c1-3-5-7-21(23(25)26)36(31,32)19-13-9-17(10-14-19)35(29,30)18-11-15-20(16-12-18)37(33,34)22(24(27)28)8-6-4-2/h9-16,21-22H,3-8H2,1-2H3,(H,25,26)(H,27,28)