2-[[4-[(2-methyl-3,5-dinitro-phenyl)carbonylamino]phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(2-methyl-3,5-dinitro-phenyl)carbonylamino]phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-[(2-methyl-3,5-dinitro-benzoyl)amino]benzoyl]amino]acetic acid CAS Name: 2-[[[4-[[(2-methyl-3,5-dinitrophenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-[(2-methyl-3,5-dinitrobenzoyl)amino]benzoyl]amino]acetic acid Traditional Name: 2-[[4-[(2-methyl-3,5-dinitro-benzoyl)amino]benzoyl]amino]acetic acid Formula: C17H14N4O8 MolecularWeight: 402.31506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)NC2=CC=C(C=C2)C(=O)NCC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)NC2=CC=C(C=C2)C(=O)NCC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O8/c1-9-13(6-12(20(26)27)7-14(9)21(28)29)17(25)19-11-4-2-10(3-5-11)16(24)18-8-15(22)23/h2-7H,8H2,1H3,(H,18,24)(H,19,25)(H,22,23)