ethyl 3-[[(4-methylphenyl)carbonylamino]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[(4-methylphenyl)carbonylamino]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[(4-methylbenzoyl)amino]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[(4-methylphenyl)-oxomethyl]hydrazo]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[(4-methylbenzoyl)amino]carbamoyl]-5-nitrobenzoate Traditional Name: 3-nitro-5-[(p-toluoylamino)carbamoyl]benzoic acid ethyl ester Formula: C18H17N3O6 MolecularWeight: 371.34408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NNC(=O)C2=CC=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NNC(=O)C2=CC=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O6/c1-3-27-18(24)14-8-13(9-15(10-14)21(25)26)17(23)20-19-16(22)12-6-4-11(2)5-7-12/h4-10H,3H2,1-2H3,(H,19,22)(H,20,23)