N'-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanehydrazide

Systemtic Name: N'-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanehydrazide Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N'-[(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide CAS Name: N'-[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-2-[4-(phenylmethyl)-1-piperazin-1-iumyl]acetohydrazide IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N'-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N'-[(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide Formula: C20H24BrN4O2+ MolecularWeight: 432.33416

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NNC=C2C=C(C=CC2=O)Br)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NNC=C2C=C(C=CC2=O)Br)CC3=CC=CC=C3

InChI

InChI=1S/C20H23BrN4O2/c21-18-6-7-19(26)17(12-18)13-22-23-20(27)15-25-10-8-24(9-11-25)14-16-4-2-1-3-5-16/h1-7,12-13,22H,8-11,14-15H2,(H,23,27)/p+1