methyl 5-(bromomethyl)-2-nitro-benzoate

Systemtic Name: methyl 5-(bromomethyl)-2-nitro-benzoate Openeye Name: methyl 5-(bromomethyl)-2-nitro-benzoate CAS Name: 5-(bromomethyl)-2-nitrobenzoic acid methyl ester IUPAC Name: methyl 5-(bromomethyl)-2-nitrobenzoate Traditional Name: 5-(bromomethyl)-2-nitro-benzoic acid methyl ester Formula: C9H8BrNO4 MolecularWeight: 274.06812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8BrNO4/c1-15-9(12)7-4-6(5-10)2-3-8(7)11(13)14/h2-4H,5H2,1H3