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

Systemtic Name: 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzoic acid Openeye Name: 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzoic acid CAS Name: 2-[(2-methyl-5-nitrophenyl)sulfonylamino]benzoic acid IUPAC Name: 2-[(2-methyl-5-nitrophenyl)sulfonylamino]benzoic acid Traditional Name: 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzoic acid Formula: C14H12N2O6S MolecularWeight: 336.31988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2C(=O)O

InChI

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