N'-[(Z)-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-3-(2-butoxyphenyl)-1H-pyrazole-5-carbohydrazide

Systemtic Name: N'-[(Z)-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-3-(2-butoxyphenyl)-1H-pyrazole-5-carbohydrazide Openeye Name: N'-[(Z)-(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-3-(2-butoxyphenyl)-1H-pyrazole-5-carbohydrazide CAS Name: N'-[(Z)-(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-3-(2-butoxyphenyl)-1H-pyrazole-5-carbohydrazide IUPAC Name: N'-[(Z)-(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-3-(2-butoxyphenyl)-1H-pyrazole-5-carbohydrazide Traditional Name: N'-[(Z)-(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]-3-(2-butoxyphenyl)-1H-pyrazole-5-carbohydrazide Formula: C21H21BrN4O3 MolecularWeight: 457.32044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C2=NNC(=C2)C(=O)NNC=C3C=C(C=CC3=O)Br

Isomeric SMILES

CCCCOC1=CC=CC=C1C2=NNC(=C2)C(=O)NN/C=C\3/C=C(C=CC3=O)Br

InChI

InChI=1S/C21H21BrN4O3/c1-2-3-10-29-20-7-5-4-6-16(20)17-12-18(25-24-17)21(28)26-23-13-14-11-15(22)8-9-19(14)27/h4-9,11-13,23H,2-3,10H2,1H3,(H,24,25)(H,26,28)/b14-13-