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

Systemtic Name: (2R)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propanenitrile Openeye Name: (2R)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propanenitrile CAS Name: (2R)-2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]propanenitrile IUPAC Name: (2R)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propanenitrile Traditional Name: (2R)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propionitrile Formula: C14H20N3O+ MolecularWeight: 246.3281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O/c1-12(11-15)16-7-9-17(10-8-16)13-3-5-14(18-2)6-4-13/h3-6,12H,7-10H2,1-2H3/p+1/t12-/m1/s1