(2R)-2-(3-methoxyphenyl)-2-piperazin-4-ium-1-yl-propanenitrile

Systemtic Name: (2R)-2-(3-methoxyphenyl)-2-piperazin-4-ium-1-yl-propanenitrile Openeye Name: (2R)-2-(3-methoxyphenyl)-2-piperazin-4-ium-1-yl-propanenitrile CAS Name: (2R)-2-(3-methoxyphenyl)-2-(1-piperazin-4-iumyl)propanenitrile IUPAC Name: (2R)-2-(3-methoxyphenyl)-2-piperazin-4-ium-1-ylpropanenitrile Traditional Name: (2R)-2-(3-methoxyphenyl)-2-piperazin-4-ium-1-yl-propionitrile Formula: C14H20N3O+ MolecularWeight: 246.3281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1=CC(=CC=C1)OC)N2CC[NH2+]CC2

Isomeric SMILES

C[C@](C#N)(C1=CC(=CC=C1)OC)N2CC[NH2+]CC2

InChI

InChI=1S/C14H19N3O/c1-14(11-15,17-8-6-16-7-9-17)12-4-3-5-13(10-12)18-2/h3-5,10,16H,6-9H2,1-2H3/p+1/t14-/m0/s1