3-methyl-4-[(4-methyl-3,5-dinitro-phenyl)carbonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[(4-methyl-3,5-dinitro-phenyl)carbonylamino]benzoic acid Openeye Name: 3-methyl-4-[(4-methyl-3,5-dinitro-benzoyl)amino]benzoic acid CAS Name: 3-methyl-4-[[(4-methyl-3,5-dinitrophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[(4-methyl-3,5-dinitrobenzoyl)amino]benzoic acid Traditional Name: 3-methyl-4-[(4-methyl-3,5-dinitro-benzoyl)amino]benzoic acid Formula: C16H13N3O7 MolecularWeight: 359.29032

Click to see the large picture

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)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O7/c1-8-5-10(16(21)22)3-4-12(8)17-15(20)11-6-13(18(23)24)9(2)14(7-11)19(25)26/h3-7H,1-2H3,(H,17,20)(H,21,22)