2-[[2-(4-methylpiperazin-4-ium-1-yl)phenyl]methylidene]propanedinitrile

Systemtic Name: 2-[[2-(4-methylpiperazin-4-ium-1-yl)phenyl]methylidene]propanedinitrile Openeye Name: 2-[[2-(4-methylpiperazin-4-ium-1-yl)phenyl]methylene]propanedinitrile CAS Name: 2-[[2-(4-methyl-1-piperazin-4-iumyl)phenyl]methylidene]propanedinitrile IUPAC Name: 2-[[2-(4-methylpiperazin-4-ium-1-yl)phenyl]methylidene]propanedinitrile Traditional Name: 2-[2-(4-methylpiperazin-4-ium-1-yl)benzylidene]malononitrile Formula: C15H17N4+ MolecularWeight: 253.32228

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2C=C(C#N)C#N

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2C=C(C#N)C#N

InChI

InChI=1S/C15H16N4/c1-18-6-8-19(9-7-18)15-5-3-2-4-14(15)10-13(11-16)12-17/h2-5,10H,6-9H2,1H3/p+1