4-bromanyl-N'-[5-nitro-6-[(3-nitrophenyl)amino]pyrimidin-4-yl]benzohydrazide

Systemtic Name: 4-bromanyl-N'-[5-nitro-6-[(3-nitrophenyl)amino]pyrimidin-4-yl]benzohydrazide Openeye Name: 4-bromo-N'-[5-nitro-6-(3-nitroanilino)pyrimidin-4-yl]benzohydrazide CAS Name: 4-bromo-N'-[5-nitro-6-(3-nitroanilino)-4-pyrimidinyl]benzohydrazide IUPAC Name: 4-bromo-N'-[5-nitro-6-(3-nitroanilino)pyrimidin-4-yl]benzohydrazide Traditional Name: 4-bromo-N'-[5-nitro-6-(3-nitroanilino)pyrimidin-4-yl]benzohydrazide Formula: C17H12BrN7O5 MolecularWeight: 474.22508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=C(C(=NC=N2)NNC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=C(C(=NC=N2)NNC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H12BrN7O5/c18-11-6-4-10(5-7-11)17(26)23-22-16-14(25(29)30)15(19-9-20-16)21-12-2-1-3-13(8-12)24(27)28/h1-9H,(H,23,26)(H2,19,20,21,22)