3-acetamido-5-nitro-benzoate

Systemtic Name: 3-acetamido-5-nitro-benzoate Openeye Name: 3-acetamido-5-nitro-benzoate CAS Name: 3-acetamido-5-nitrobenzoate IUPAC Name: 3-acetamido-5-nitrobenzoate Traditional Name: 3-acetamido-5-nitro-benzoate Formula: C9H7N2O5- MolecularWeight: 223.16228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H8N2O5/c1-5(12)10-7-2-6(9(13)14)3-8(4-7)11(15)16/h2-4H,1H3,(H,10,12)(H,13,14)/p-1