5-[(3-methyl-4-nitro-phenyl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: 5-[(3-methyl-4-nitro-phenyl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: 5-[(3-methyl-4-nitro-benzoyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]benzene-1,3-dicarboxylate IUPAC Name: 5-[(3-methyl-4-nitrobenzoyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(3-methyl-4-nitro-benzoyl)amino]isophthalate Formula: C16H10N2O7-2 MolecularWeight: 342.2598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O7/c1-8-4-9(2-3-13(8)18(24)25)14(19)17-12-6-10(15(20)21)5-11(7-12)16(22)23/h2-7H,1H3,(H,17,19)(H,20,21)(H,22,23)/p-2