azanium 3-acetamido-4-methyl-2-nitro-benzoate

Systemtic Name: azanium 3-acetamido-4-methyl-2-nitro-benzoate Openeye Name: ammonium 3-acetamido-4-methyl-2-nitro-benzoate CAS Name: ammonium 3-acetamido-4-methyl-2-nitrobenzoate IUPAC Name: azanium 3-acetamido-4-methyl-2-nitrobenzoate Traditional Name: ammonium 3-acetamido-4-methyl-2-nitro-benzoate Formula: C10H13N3O5 MolecularWeight: 255.22732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)[O-])[N+](=O)[O-])NC(=O)C.[NH4+]

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)[O-])[N+](=O)[O-])NC(=O)C.[NH4+]

InChI

InChI=1S/C10H10N2O5.H3N/c1-5-3-4-7(10(14)15)9(12(16)17)8(5)11-6(2)13;/h3-4H,1-2H3,(H,11,13)(H,14,15);1H3