butyl 3-[(3,5-dinitrophenyl)carbonylamino]benzoate

Systemtic Name: butyl 3-[(3,5-dinitrophenyl)carbonylamino]benzoate Openeye Name: butyl 3-[(3,5-dinitrobenzoyl)amino]benzoate CAS Name: 3-[[(3,5-dinitrophenyl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[(3,5-dinitrobenzoyl)amino]benzoate Traditional Name: 3-[(3,5-dinitrobenzoyl)amino]benzoic acid butyl ester Formula: C18H17N3O7 MolecularWeight: 387.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O7/c1-2-3-7-28-18(23)12-5-4-6-14(8-12)19-17(22)13-9-15(20(24)25)11-16(10-13)21(26)27/h4-6,8-11H,2-3,7H2,1H3,(H,19,22)