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

Systemtic Name: methyl 4-acetamido-3-nitro-2-oxidanyl-benzoate Openeye Name: methyl 4-acetamido-2-hydroxy-3-nitro-benzoate CAS Name: 4-acetamido-2-hydroxy-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-acetamido-2-hydroxy-3-nitrobenzoate Traditional Name: 4-acetamido-2-hydroxy-3-nitro-benzoic acid methyl ester Formula: C10H10N2O6 MolecularWeight: 254.1962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10N2O6/c1-5(13)11-7-4-3-6(10(15)18-2)9(14)8(7)12(16)17/h3-4,14H,1-2H3,(H,11,13)