methyl 3-ethanoyl-5-nitro-benzoate

Systemtic Name: methyl 3-ethanoyl-5-nitro-benzoate Openeye Name: methyl 3-acetyl-5-nitro-benzoate CAS Name: 3-acetyl-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-acetyl-5-nitrobenzoate Traditional Name: 3-acetyl-5-nitro-benzoic acid methyl ester Formula: C10H9NO5 MolecularWeight: 223.18216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO5/c1-6(12)7-3-8(10(13)16-2)5-9(4-7)11(14)15/h3-5H,1-2H3