[3-bromanyl-4-(2,4-dinitrophenyl)carbonyloxy-phenyl] 2,4-dinitrobenzoate

Systemtic Name: [3-bromanyl-4-(2,4-dinitrophenyl)carbonyloxy-phenyl] 2,4-dinitrobenzoate Openeye Name: [3-bromo-4-(2,4-dinitrobenzoyl)oxy-phenyl] 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid [3-bromo-4-[(2,4-dinitrophenyl)-oxomethoxy]phenyl] ester IUPAC Name: [3-bromo-4-(2,4-dinitrobenzoyl)oxyphenyl] 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid [3-bromo-4-(2,4-dinitrobenzoyl)oxy-phenyl] ester Formula: C20H9BrN4O12 MolecularWeight: 577.20906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)OC2=CC(=C(C=C2)OC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)OC2=CC(=C(C=C2)OC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C20H9BrN4O12/c21-15-9-12(36-19(26)13-4-1-10(22(28)29)7-16(13)24(32)33)3-6-18(15)37-20(27)14-5-2-11(23(30)31)8-17(14)25(34)35/h1-9H