3-[[2-methyl-5-(phenylsulfonyl)phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-[[2-methyl-5-(phenylsulfonyl)phenyl]sulfonylamino]benzoic acid Openeye Name: 3-[[5-(benzenesulfonyl)-2-methyl-phenyl]sulfonylamino]benzoic acid CAS Name: 3-[[5-(benzenesulfonyl)-2-methylphenyl]sulfonylamino]benzoic acid IUPAC Name: 3-[[5-(benzenesulfonyl)-2-methylphenyl]sulfonylamino]benzoic acid Traditional Name: 3-[(5-besyl-2-methyl-phenyl)sulfonylamino]benzoic acid Formula: C20H17NO6S2 MolecularWeight: 431.48208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C20H17NO6S2/c1-14-10-11-18(28(24,25)17-8-3-2-4-9-17)13-19(14)29(26,27)21-16-7-5-6-15(12-16)20(22)23/h2-13,21H,1H3,(H,22,23)