(2-methylphenyl)carbonyl 2-[(2-methylphenyl)carbonylamino]-5-nitro-benzoate

Systemtic Name: (2-methylphenyl)carbonyl 2-[(2-methylphenyl)carbonylamino]-5-nitro-benzoate Openeye Name: (2-methylbenzoyl) 2-[(2-methylbenzoyl)amino]-5-nitro-benzoate CAS Name: 2-[[(2-methylphenyl)-oxomethyl]amino]-5-nitrobenzoic acid [(2-methylphenyl)-oxomethyl] ester IUPAC Name: (2-methylbenzoyl) 2-[(2-methylbenzoyl)amino]-5-nitrobenzoate Traditional Name: 5-nitro-2-(o-toluoylamino)benzoic acid o-toluoyl ester Formula: C23H18N2O6 MolecularWeight: 418.39882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC(=O)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C23H18N2O6/c1-14-7-3-5-9-17(14)21(26)24-20-12-11-16(25(29)30)13-19(20)23(28)31-22(27)18-10-6-4-8-15(18)2/h3-13H,1-2H3,(H,24,26)