ethyl 3-[(4-chloranyl-3,5-dinitro-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 3-[(4-chloranyl-3,5-dinitro-phenyl)carbonylamino]benzoate Openeye Name: ethyl 3-[(4-chloro-3,5-dinitro-benzoyl)amino]benzoate CAS Name: 3-[[(4-chloro-3,5-dinitrophenyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(4-chloro-3,5-dinitrobenzoyl)amino]benzoate Traditional Name: 3-[(4-chloro-3,5-dinitro-benzoyl)amino]benzoic acid ethyl ester Formula: C16H12ClN3O7 MolecularWeight: 393.73538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12ClN3O7/c1-2-27-16(22)9-4-3-5-11(6-9)18-15(21)10-7-12(19(23)24)14(17)13(8-10)20(25)26/h3-8H,2H2,1H3,(H,18,21)