4-cyano-N'-[3-[4-(phenylmethyl)piperazin-4-ium-1-yl]propanoyl]benzohydrazide

Systemtic Name: 4-cyano-N'-[3-[4-(phenylmethyl)piperazin-4-ium-1-yl]propanoyl]benzohydrazide Openeye Name: N'-[3-(4-benzylpiperazin-4-ium-1-yl)propanoyl]-4-cyano-benzohydrazide CAS Name: 4-cyano-N'-[1-oxo-3-[4-(phenylmethyl)-1-piperazin-4-iumyl]propyl]benzohydrazide IUPAC Name: N'-[3-(4-benzylpiperazin-4-ium-1-yl)propanoyl]-4-cyanobenzohydrazide Traditional Name: N'-[3-(4-benzylpiperazin-4-ium-1-yl)propanoyl]-4-cyano-benzohydrazide Formula: C22H26N5O2+ MolecularWeight: 392.47414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)CCC(=O)NNC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)CCC(=O)NNC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H25N5O2/c23-16-18-6-8-20(9-7-18)22(29)25-24-21(28)10-11-26-12-14-27(15-13-26)17-19-4-2-1-3-5-19/h1-9H,10-15,17H2,(H,24,28)(H,25,29)/p+1