4-methyl-3-[(4-nitrophenyl)sulfonylamino]benzoic acid

Systemtic Name: 4-methyl-3-[(4-nitrophenyl)sulfonylamino]benzoic acid Openeye Name: 4-methyl-3-[(4-nitrophenyl)sulfonylamino]benzoic acid CAS Name: 4-methyl-3-[(4-nitrophenyl)sulfonylamino]benzoic acid IUPAC Name: 4-methyl-3-[(4-nitrophenyl)sulfonylamino]benzoic acid Traditional Name: 4-methyl-3-(nosylamino)benzoic acid Formula: C14H12N2O6S MolecularWeight: 336.31988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O6S/c1-9-2-3-10(14(17)18)8-13(9)15-23(21,22)12-6-4-11(5-7-12)16(19)20/h2-8,15H,1H3,(H,17,18)