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

Systemtic Name: (2R)-2-(3,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-propanenitrile Openeye Name: (2R)-2-(3,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-propanenitrile CAS Name: (2R)-2-(3,4-dimethoxyphenyl)-2-(1-piperazin-4-iumyl)propanenitrile IUPAC Name: (2R)-2-(3,4-dimethoxyphenyl)-2-piperazin-4-ium-1-ylpropanenitrile Traditional Name: (2R)-2-(3,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-propionitrile Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O2/c1-15(11-16,18-8-6-17-7-9-18)12-4-5-13(19-2)14(10-12)20-3/h4-5,10,17H,6-9H2,1-3H3/p+1/t15-/m0/s1