3-methyl-4-[(3-methyl-4-nitro-phenyl)carbonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[(3-methyl-4-nitro-phenyl)carbonylamino]benzoic acid Openeye Name: 3-methyl-4-[(3-methyl-4-nitro-benzoyl)amino]benzoic acid CAS Name: 3-methyl-4-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[(3-methyl-4-nitrobenzoyl)amino]benzoic acid Traditional Name: 3-methyl-4-[(3-methyl-4-nitro-benzoyl)amino]benzoic acid Formula: C16H14N2O5 MolecularWeight: 314.29276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O5/c1-9-7-12(16(20)21)3-5-13(9)17-15(19)11-4-6-14(18(22)23)10(2)8-11/h3-8H,1-2H3,(H,17,19)(H,20,21)