3-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 3-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]benzoic acid Openeye Name: 3-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]benzoic acid CAS Name: 3-[(2,3-dimethyl-5-nitrophenyl)sulfonylamino]benzoic acid IUPAC Name: 3-[(2,3-dimethyl-5-nitrophenyl)sulfonylamino]benzoic acid Traditional Name: 3-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]benzoic acid Formula: C15H14N2O6S MolecularWeight: 350.34646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O6S/c1-9-6-13(17(20)21)8-14(10(9)2)24(22,23)16-12-5-3-4-11(7-12)15(18)19/h3-8,16H,1-2H3,(H,18,19)