methyl 3-bromanyl-5-methoxy-2,6-dinitro-benzoate

Systemtic Name: methyl 3-bromanyl-5-methoxy-2,6-dinitro-benzoate Openeye Name: methyl 3-bromo-5-methoxy-2,6-dinitro-benzoate CAS Name: 3-bromo-5-methoxy-2,6-dinitrobenzoic acid methyl ester IUPAC Name: methyl 3-bromo-5-methoxy-2,6-dinitrobenzoate Traditional Name: 3-bromo-5-methoxy-2,6-dinitro-benzoic acid methyl ester Formula: C9H7BrN2O7 MolecularWeight: 335.06508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1[N+](=O)[O-])C(=O)OC)[N+](=O)[O-])Br

Isomeric SMILES

COC1=CC(=C(C(=C1[N+](=O)[O-])C(=O)OC)[N+](=O)[O-])Br

InChI

InChI=1S/C9H7BrN2O7/c1-18-5-3-4(10)7(11(14)15)6(9(13)19-2)8(5)12(16)17/h3H,1-2H3