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

Systemtic Name: N'-[(1Z)-1-[1-(4-nitrophenyl)-5-oxidanylidene-3-propyl-pyrazol-4-ylidene]ethyl]benzohydrazide Openeye Name: N'-[(1Z)-1-[1-(4-nitrophenyl)-5-oxo-3-propyl-pyrazol-4-ylidene]ethyl]benzohydrazide CAS Name: N'-[(1Z)-1-[1-(4-nitrophenyl)-5-oxo-3-propyl-4-pyrazolylidene]ethyl]benzohydrazide IUPAC Name: N'-[(1Z)-1-[1-(4-nitrophenyl)-5-oxo-3-propylpyrazol-4-ylidene]ethyl]benzohydrazide Traditional Name: N'-[(1Z)-1-[5-keto-1-(4-nitrophenyl)-3-propyl-2-pyrazolin-4-ylidene]ethyl]benzohydrazide Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O4/c1-3-7-18-19(14(2)22-23-20(27)15-8-5-4-6-9-15)21(28)25(24-18)16-10-12-17(13-11-16)26(29)30/h4-6,8-13,22H,3,7H2,1-2H3,(H,23,27)/b19-14-