2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-2-methyl-propanenitrile

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-2-methyl-propanenitrile Openeye Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-2-methyl-propanenitrile CAS Name: 2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]-2-methylpropanenitrile IUPAC Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-2-methylpropanenitrile Traditional Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-2-methyl-propionitrile Formula: C15H22N3O+ MolecularWeight: 260.35468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O/c1-15(2,12-16)18-10-8-17(9-11-18)13-4-6-14(19-3)7-5-13/h4-7H,8-11H2,1-3H3/p+1