[3-(4-bromanyl-3-nitro-phenyl)carbonyloxy-5-methyl-phenyl] 4-bromanyl-3-nitro-benzoate

Systemtic Name: [3-(4-bromanyl-3-nitro-phenyl)carbonyloxy-5-methyl-phenyl] 4-bromanyl-3-nitro-benzoate Openeye Name: [3-(4-bromo-3-nitro-benzoyl)oxy-5-methyl-phenyl] 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid [3-[(4-bromo-3-nitrophenyl)-oxomethoxy]-5-methylphenyl] ester IUPAC Name: [3-(4-bromo-3-nitrobenzoyl)oxy-5-methylphenyl] 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid [3-(4-bromo-3-nitro-benzoyl)oxy-5-methyl-phenyl] ester Formula: C21H12Br2N2O8 MolecularWeight: 580.13658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])OC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1)OC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])OC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C21H12Br2N2O8/c1-11-6-14(32-20(26)12-2-4-16(22)18(8-12)24(28)29)10-15(7-11)33-21(27)13-3-5-17(23)19(9-13)25(30)31/h2-10H,1H3