methyl N-(2-bromanyl-3,5-dinitro-phenyl)carbamate

Systemtic Name: methyl N-(2-bromanyl-3,5-dinitro-phenyl)carbamate Openeye Name: methyl N-(2-bromo-3,5-dinitro-phenyl)carbamate CAS Name: N-(2-bromo-3,5-dinitrophenyl)carbamic acid methyl ester IUPAC Name: methyl N-(2-bromo-3,5-dinitrophenyl)carbamate Traditional Name: N-(2-bromo-3,5-dinitro-phenyl)carbamic acid methyl ester Formula: C8H6BrN3O6 MolecularWeight: 320.05374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC(=CC(=C1Br)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)NC1=CC(=CC(=C1Br)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H6BrN3O6/c1-18-8(13)10-5-2-4(11(14)15)3-6(7(5)9)12(16)17/h2-3H,1H3,(H,10,13)