methyl 4-bromanyl-2-chloranyl-5-nitro-benzoate

Systemtic Name: methyl 4-bromanyl-2-chloranyl-5-nitro-benzoate Openeye Name: methyl 4-bromo-2-chloro-5-nitro-benzoate CAS Name: 4-bromo-2-chloro-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-bromo-2-chloro-5-nitrobenzoate Traditional Name: 4-bromo-2-chloro-5-nitro-benzoic acid methyl ester Formula: C8H5BrClNO4 MolecularWeight: 294.4866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1Cl)Br)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1Cl)Br)[N+](=O)[O-]

InChI

InChI=1S/C8H5BrClNO4/c1-15-8(12)4-2-7(11(13)14)5(9)3-6(4)10/h2-3H,1H3