2-bromanyl-N'-[(1Z)-1-[1-(4-nitrophenyl)-5-oxidanylidene-3-propyl-pyrazol-4-ylidene]ethyl]benzohydrazide

Systemtic Name: 2-bromanyl-N'-[(1Z)-1-[1-(4-nitrophenyl)-5-oxidanylidene-3-propyl-pyrazol-4-ylidene]ethyl]benzohydrazide Openeye Name: 2-bromo-N'-[(1Z)-1-[1-(4-nitrophenyl)-5-oxo-3-propyl-pyrazol-4-ylidene]ethyl]benzohydrazide CAS Name: 2-bromo-N'-[(1Z)-1-[1-(4-nitrophenyl)-5-oxo-3-propyl-4-pyrazolylidene]ethyl]benzohydrazide IUPAC Name: 2-bromo-N'-[(1Z)-1-[1-(4-nitrophenyl)-5-oxo-3-propylpyrazol-4-ylidene]ethyl]benzohydrazide Traditional Name: 2-bromo-N'-[(1Z)-1-[5-keto-1-(4-nitrophenyl)-3-propyl-2-pyrazolin-4-ylidene]ethyl]benzohydrazide Formula: C21H20BrN5O4 MolecularWeight: 486.3186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NNC(=O)C2=CC=CC=C2Br)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NNC(=O)C2=CC=CC=C2Br)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20BrN5O4/c1-3-6-18-19(13(2)23-24-20(28)16-7-4-5-8-17(16)22)21(29)26(25-18)14-9-11-15(12-10-14)27(30)31/h4-5,7-12,23H,3,6H2,1-2H3,(H,24,28)/b19-13-