4,5-dimethoxy-2-[(3-methylsulfonylphenyl)carbonylamino]benzoic acid

Systemtic Name: 4,5-dimethoxy-2-[(3-methylsulfonylphenyl)carbonylamino]benzoic acid Openeye Name: 4,5-dimethoxy-2-[(3-methylsulfonylbenzoyl)amino]benzoic acid CAS Name: 4,5-dimethoxy-2-[[(3-methylsulfonylphenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4,5-dimethoxy-2-[(3-methylsulfonylbenzoyl)amino]benzoic acid Traditional Name: 2-[(3-mesylbenzoyl)amino]-4,5-dimethoxy-benzoic acid Formula: C17H17NO7S MolecularWeight: 379.38438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)O)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)O)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C)OC

InChI

InChI=1S/C17H17NO7S/c1-24-14-8-12(17(20)21)13(9-15(14)25-2)18-16(19)10-5-4-6-11(7-10)26(3,22)23/h4-9H,1-3H3,(H,18,19)(H,20,21)