[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-bromanyl-3,5-dinitro-benzoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-bromanyl-3,5-dinitro-benzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-bromo-3,5-dinitro-benzoate CAS Name: 4-bromo-3,5-dinitrobenzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-bromo-3,5-dinitrobenzoate Traditional Name: 4-bromo-3,5-dinitro-benzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C15H8Br2N2O7 MolecularWeight: 488.04122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)COC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])Br)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)COC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])Br)[N+](=O)[O-])Br

InChI

InChI=1S/C15H8Br2N2O7/c16-10-3-1-8(2-4-10)13(20)7-26-15(21)9-5-11(18(22)23)14(17)12(6-9)19(24)25/h1-6H,7H2