(2-bromanyl-4-methanoyl-6-methoxy-phenyl) 3,5-dinitrobenzoate

Systemtic Name: (2-bromanyl-4-methanoyl-6-methoxy-phenyl) 3,5-dinitrobenzoate Openeye Name: (2-bromo-4-formyl-6-methoxy-phenyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (2-bromo-4-formyl-6-methoxyphenyl) ester IUPAC Name: (2-bromo-4-formyl-6-methoxyphenyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (2-bromo-4-formyl-6-methoxy-phenyl) ester Formula: C15H9BrN2O8 MolecularWeight: 425.14456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)Br)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)Br)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9BrN2O8/c1-25-13-3-8(7-19)2-12(16)14(13)26-15(20)9-4-10(17(21)22)6-11(5-9)18(23)24/h2-7H,1H3