(2R)-2-(4-hydroxyphenyl)-2-piperidin-1-ium-1-yl-ethanenitrile

Systemtic Name: (2R)-2-(4-hydroxyphenyl)-2-piperidin-1-ium-1-yl-ethanenitrile Openeye Name: (2R)-2-(4-hydroxyphenyl)-2-piperidin-1-ium-1-yl-acetonitrile CAS Name: (2R)-2-(4-hydroxyphenyl)-2-(1-piperidin-1-iumyl)acetonitrile IUPAC Name: (2R)-2-(4-hydroxyphenyl)-2-piperidin-1-ium-1-ylacetonitrile Traditional Name: (2R)-2-(4-hydroxyphenyl)-2-piperidin-1-ium-1-yl-acetonitrile Formula: C13H17N2O+ MolecularWeight: 217.28688

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(C#N)C2=CC=C(C=C2)O

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](C#N)C2=CC=C(C=C2)O

InChI

InChI=1S/C13H16N2O/c14-10-13(15-8-2-1-3-9-15)11-4-6-12(16)7-5-11/h4-7,13,16H,1-3,8-9H2/p+1/t13-/m0/s1