2-methylpropyl 3-[(2,4-dinitrophenyl)carbonylamino]benzoate

Systemtic Name: 2-methylpropyl 3-[(2,4-dinitrophenyl)carbonylamino]benzoate Openeye Name: isobutyl 3-[(2,4-dinitrobenzoyl)amino]benzoate CAS Name: 3-[[(2,4-dinitrophenyl)-oxomethyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-[(2,4-dinitrobenzoyl)amino]benzoate Traditional Name: 3-[(2,4-dinitrobenzoyl)amino]benzoic acid isobutyl ester Formula: C18H17N3O7 MolecularWeight: 387.34348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O7/c1-11(2)10-28-18(23)12-4-3-5-13(8-12)19-17(22)15-7-6-14(20(24)25)9-16(15)21(26)27/h3-9,11H,10H2,1-2H3,(H,19,22)