4-bromanyl-N'-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-ium-1-yl]ethanoyl]benzohydrazide

Systemtic Name: 4-bromanyl-N'-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-ium-1-yl]ethanoyl]benzohydrazide Openeye Name: 4-bromo-N'-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-ium-1-yl]acetyl]benzohydrazide CAS Name: 4-bromo-N'-[2-[4-[(3-chlorophenyl)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]benzohydrazide IUPAC Name: 4-bromo-N'-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-ium-1-yl]acetyl]benzohydrazide Traditional Name: 4-bromo-N'-[2-[4-(3-chlorobenzyl)piperazin-1-ium-1-yl]acetyl]benzohydrazide Formula: C20H23BrClN4O2+ MolecularWeight: 466.77922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NNC(=O)C2=CC=C(C=C2)Br)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NNC(=O)C2=CC=C(C=C2)Br)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22BrClN4O2/c21-17-6-4-16(5-7-17)20(28)24-23-19(27)14-26-10-8-25(9-11-26)13-15-2-1-3-18(22)12-15/h1-7,12H,8-11,13-14H2,(H,23,27)(H,24,28)/p+1