5-nitro-N'-[(E)-(6-oxidanylidene-5-prop-2-enyl-cyclohexa-2,4-dien-1-ylidene)methyl]-2-(phenylmethyl)pyrazole-3-carbohydrazide

Systemtic Name: 5-nitro-N'-[(E)-(6-oxidanylidene-5-prop-2-enyl-cyclohexa-2,4-dien-1-ylidene)methyl]-2-(phenylmethyl)pyrazole-3-carbohydrazide Openeye Name: N'-[(E)-(5-allyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-2-benzyl-5-nitro-pyrazole-3-carbohydrazide CAS Name: 5-nitro-N'-[(E)-(6-oxo-5-prop-2-enyl-1-cyclohexa-2,4-dienylidene)methyl]-2-(phenylmethyl)-3-pyrazolecarbohydrazide IUPAC Name: 2-benzyl-5-nitro-N'-[(E)-(6-oxo-5-prop-2-enylcyclohexa-2,4-dien-1-ylidene)methyl]pyrazole-3-carbohydrazide Traditional Name: N'-[(E)-(5-allyl-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]-2-benzyl-5-nitro-pyrazole-3-carbohydrazide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC(=CNNC(=O)C2=CC(=NN2CC3=CC=CC=C3)[N+](=O)[O-])C1=O

Isomeric SMILES

C=CCC1=CC=C/C(=C\NNC(=O)C2=CC(=NN2CC3=CC=CC=C3)[N+](=O)[O-])/C1=O

InChI

InChI=1S/C21H19N5O4/c1-2-7-16-10-6-11-17(20(16)27)13-22-23-21(28)18-12-19(26(29)30)24-25(18)14-15-8-4-3-5-9-15/h2-6,8-13,22H,1,7,14H2,(H,23,28)/b17-13+