2-[(3,5-dinitrophenyl)carbonylamino]ethanoate

Systemtic Name: 2-[(3,5-dinitrophenyl)carbonylamino]ethanoate Openeye Name: 2-[(3,5-dinitrobenzoyl)amino]acetate CAS Name: 2-[[(3,5-dinitrophenyl)-oxomethyl]amino]acetate IUPAC Name: 2-[(3,5-dinitrobenzoyl)amino]acetate Traditional Name: 2-[(3,5-dinitrobenzoyl)amino]acetate Formula: C9H6N3O7- MolecularWeight: 268.15984

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NCC(=O)[O-]

Isomeric SMILES

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NCC(=O)[O-]

InChI

InChI=1S/C9H7N3O7/c13-8(14)4-10-9(15)5-1-6(11(16)17)3-7(2-5)12(18)19/h1-3H,4H2,(H,10,15)(H,13,14)/p-1