methyl 4-acetamido-3-nitro-benzoate

Systemtic Name: methyl 4-acetamido-3-nitro-benzoate Openeye Name: methyl 4-acetamido-3-nitro-benzoate CAS Name: 4-acetamido-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-acetamido-3-nitrobenzoate Traditional Name: 4-acetamido-3-nitro-benzoic acid methyl ester Formula: C10H10N2O5 MolecularWeight: 238.1968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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