methyl 3-[bis(bromanyl)methyl]-4-nitro-benzoate

Systemtic Name: methyl 3-[bis(bromanyl)methyl]-4-nitro-benzoate Openeye Name: methyl 3-(dibromomethyl)-4-nitro-benzoate CAS Name: 3-(dibromomethyl)-4-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-(dibromomethyl)-4-nitrobenzoate Traditional Name: 3-(dibromomethyl)-4-nitro-benzoic acid methyl ester Formula: C9H7Br2NO4 MolecularWeight: 352.96418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7Br2NO4/c1-16-9(13)5-2-3-7(12(14)15)6(4-5)8(10)11/h2-4,8H,1H3