[3-[[(3,5-dinitrophenyl)carbonylhydrazinylidene]methyl]phenyl] 2-bromanylbenzoate

Systemtic Name: [3-[[(3,5-dinitrophenyl)carbonylhydrazinylidene]methyl]phenyl] 2-bromanylbenzoate Openeye Name: [3-[[(3,5-dinitrobenzoyl)hydrazono]methyl]phenyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [3-[[[(3,5-dinitrophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[[(3,5-dinitrobenzoyl)hydrazinylidene]methyl]phenyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [3-[[(3,5-dinitrobenzoyl)hydrazono]methyl]phenyl] ester Formula: C21H13BrN4O7 MolecularWeight: 513.25452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13BrN4O7/c22-19-7-2-1-6-18(19)21(28)33-17-5-3-4-13(8-17)12-23-24-20(27)14-9-15(25(29)30)11-16(10-14)26(31)32/h1-12H,(H,24,27)