[2-bromanyl-6-methoxy-4-(2-nitroethenyl)phenyl] 4-nitrobenzoate

Systemtic Name: [2-bromanyl-6-methoxy-4-(2-nitroethenyl)phenyl] 4-nitrobenzoate Openeye Name: [2-bromo-6-methoxy-4-(2-nitrovinyl)phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-bromo-6-methoxy-4-(2-nitroethenyl)phenyl] ester IUPAC Name: [2-bromo-6-methoxy-4-(2-nitroethenyl)phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-bromo-6-methoxy-4-(2-nitrovinyl)phenyl] ester Formula: C16H11BrN2O7 MolecularWeight: 423.17174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrN2O7/c1-25-14-9-10(6-7-18(21)22)8-13(17)15(14)26-16(20)11-2-4-12(5-3-11)19(23)24/h2-9H,1H3