3-(4-butoxyphenyl)-N'-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-5-carbohydrazide

Systemtic Name: 3-(4-butoxyphenyl)-N'-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-5-carbohydrazide Openeye Name: 3-(4-butoxyphenyl)-N'-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-5-carbohydrazide CAS Name: 3-(4-butoxyphenyl)-N'-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-1H-pyrazole-5-carbohydrazide IUPAC Name: 3-(4-butoxyphenyl)-N'-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-5-carbohydrazide Traditional Name: 3-(4-butoxyphenyl)-N'-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-5-carbohydrazide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NNC=C3C=CC(=O)C=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NNC=C3C=CC(=O)C=C3

InChI

InChI=1S/C21H22N4O3/c1-2-3-12-28-18-10-6-16(7-11-18)19-13-20(24-23-19)21(27)25-22-14-15-4-8-17(26)9-5-15/h4-11,13-14,22H,2-3,12H2,1H3,(H,23,24)(H,25,27)