N'-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1-phenacyl-pyridin-1-ium-4-carbohydrazide bromide

Systemtic Name: N'-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1-phenacyl-pyridin-1-ium-4-carbohydrazide bromide Openeye Name: N'-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1-phenacyl-pyridin-1-ium-4-carbohydrazide bromide CAS Name: N'-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-1-phenacyl-4-pyridin-1-iumcarbohydrazide bromide IUPAC Name: N'-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1-phenacylpyridin-1-ium-4-carbohydrazide bromide Traditional Name: N'-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-1-phenacyl-pyridin-1-ium-4-carbohydrazide bromide Formula: C21H18BrN3O3 MolecularWeight: 440.28992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C(=O)NNC=C3C=CC(=O)C=C3.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C(=O)NNC=C3C=CC(=O)C=C3.[Br-]

InChI

InChI=1S/C21H17N3O3.BrH/c25-19-8-6-16(7-9-19)14-22-23-21(27)18-10-12-24(13-11-18)15-20(26)17-4-2-1-3-5-17;/h1-14,27H,15H2;1H