2,3-dibutyl-4-(4-carboxylatophenyl)sulfonyl-benzoate

Systemtic Name: 2,3-dibutyl-4-(4-carboxylatophenyl)sulfonyl-benzoate Openeye Name: 2,3-dibutyl-4-(4-carboxylatophenyl)sulfonyl-benzoate CAS Name: 2,3-dibutyl-4-(4-carboxylatophenyl)sulfonylbenzoate IUPAC Name: 2,3-dibutyl-4-(4-carboxylatophenyl)sulfonylbenzoate Traditional Name: 2,3-dibutyl-4-(4-carboxylatophenyl)sulfonyl-benzoate Formula: C22H24O6S-2 MolecularWeight: 416.48736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1CCCC)S(=O)(=O)C2=CC=C(C=C2)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCC1=C(C=CC(=C1CCCC)S(=O)(=O)C2=CC=C(C=C2)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C22H26O6S/c1-3-5-7-17-18(8-6-4-2)20(14-13-19(17)22(25)26)29(27,28)16-11-9-15(10-12-16)21(23)24/h9-14H,3-8H2,1-2H3,(H,23,24)(H,25,26)/p-2