3-[1-methyl-4-(4-methylphenyl)piperazin-1-ium-1-yl]propanenitrile

Systemtic Name: 3-[1-methyl-4-(4-methylphenyl)piperazin-1-ium-1-yl]propanenitrile Openeye Name: 3-[1-methyl-4-(p-tolyl)piperazin-1-ium-1-yl]propanenitrile CAS Name: 3-[1-methyl-4-(4-methylphenyl)-1-piperazin-1-iumyl]propanenitrile IUPAC Name: 3-[1-methyl-4-(4-methylphenyl)piperazin-1-ium-1-yl]propanenitrile Traditional Name: 3-[1-methyl-4-(p-tolyl)piperazin-1-ium-1-yl]propionitrile Formula: C15H22N3+ MolecularWeight: 244.35528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC[N+](CC2)(C)CCC#N

Isomeric SMILES

CC1=CC=C(C=C1)N2CC[N+](CC2)(C)CCC#N

InChI

InChI=1S/C15H22N3/c1-14-4-6-15(7-5-14)17-9-12-18(2,13-10-17)11-3-8-16/h4-7H,3,9-13H2,1-2H3/q+1