ethyl 2-acetamido-4,5-dinitro-benzoate

Systemtic Name: ethyl 2-acetamido-4,5-dinitro-benzoate Openeye Name: ethyl 2-acetamido-4,5-dinitro-benzoate CAS Name: 2-acetamido-4,5-dinitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-4,5-dinitrobenzoate Traditional Name: 2-acetamido-4,5-dinitro-benzoic acid ethyl ester Formula: C11H11N3O7 MolecularWeight: 297.22094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1NC(=O)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1NC(=O)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O7/c1-3-21-11(16)7-4-9(13(17)18)10(14(19)20)5-8(7)12-6(2)15/h4-5H,3H2,1-2H3,(H,12,15)