4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]benzenecarbonitrile

Systemtic Name: 4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]benzenecarbonitrile Openeye Name: 4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]benzonitrile CAS Name: 4-[(Z)-(4-methyl-1-piperazin-4-iumyl)iminomethyl]benzonitrile IUPAC Name: 4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]benzonitrile Traditional Name: 4-[(Z)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]benzonitrile Formula: C13H17N4+ MolecularWeight: 229.30088

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)N=CC2=CC=C(C=C2)C#N

Isomeric SMILES

C[NH+]1CCN(CC1)/N=C\C2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H16N4/c1-16-6-8-17(9-7-16)15-11-13-4-2-12(10-14)3-5-13/h2-5,11H,6-9H2,1H3/p+1/b15-11-