3-methyl-4-[(3-methyl-2-nitro-phenyl)carbonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[(3-methyl-2-nitro-phenyl)carbonylamino]benzoic acid Openeye Name: 3-methyl-4-[(3-methyl-2-nitro-benzoyl)amino]benzoic acid CAS Name: 3-methyl-4-[[(3-methyl-2-nitrophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[(3-methyl-2-nitrobenzoyl)amino]benzoic acid Traditional Name: 3-methyl-4-[(3-methyl-2-nitro-benzoyl)amino]benzoic acid Formula: C16H14N2O5 MolecularWeight: 314.29276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)C(=O)O)C

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)C(=O)O)C

InChI

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