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

Systemtic Name: 2-[[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]methylidene]propanedinitrile Openeye Name: 2-[[4-(4-methylpiperazin-4-ium-1-yl)anilino]methylene]propanedinitrile CAS Name: 2-[[4-(4-methyl-1-piperazin-4-iumyl)anilino]methylidene]propanedinitrile IUPAC Name: 2-[[4-(4-methylpiperazin-4-ium-1-yl)anilino]methylidene]propanedinitrile Traditional Name: 2-[[4-(4-methylpiperazin-4-ium-1-yl)anilino]methylene]malononitrile Formula: C15H18N5+ MolecularWeight: 268.33692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N5/c1-19-6-8-20(9-7-19)15-4-2-14(3-5-15)18-12-13(10-16)11-17/h2-5,12,18H,6-9H2,1H3/p+1