2,6-dimethyl-4-(phenylsulfonylcarbamoyl)benzoic acid

Systemtic Name: 2,6-dimethyl-4-(phenylsulfonylcarbamoyl)benzoic acid Openeye Name: 4-(benzenesulfonylcarbamoyl)-2,6-dimethyl-benzoic acid CAS Name: 4-[benzenesulfonamido(oxo)methyl]-2,6-dimethylbenzoic acid IUPAC Name: 4-(benzenesulfonylcarbamoyl)-2,6-dimethylbenzoic acid Traditional Name: 4-(besylcarbamoyl)-2,6-dimethyl-benzoic acid Formula: C16H15NO5S MolecularWeight: 333.359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)O)C)C(=O)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)O)C)C(=O)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H15NO5S/c1-10-8-12(9-11(2)14(10)16(19)20)15(18)17-23(21,22)13-6-4-3-5-7-13/h3-9H,1-2H3,(H,17,18)(H,19,20)