2-phenyl-2-[1-(phenylmethyl)piperidin-1-ium-4-ylidene]ethanenitrile

Systemtic Name: 2-phenyl-2-[1-(phenylmethyl)piperidin-1-ium-4-ylidene]ethanenitrile Openeye Name: 2-(1-benzylpiperidin-1-ium-4-ylidene)-2-phenyl-acetonitrile CAS Name: 2-phenyl-2-[1-(phenylmethyl)-4-piperidin-1-iumylidene]acetonitrile IUPAC Name: 2-(1-benzylpiperidin-1-ium-4-ylidene)-2-phenylacetonitrile Traditional Name: 2-(1-benzylpiperidin-1-ium-4-ylidene)-2-phenyl-acetonitrile Formula: C20H21N2+ MolecularWeight: 289.39414

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1=C(C#N)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1=C(C#N)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H20N2/c21-15-20(18-9-5-2-6-10-18)19-11-13-22(14-12-19)16-17-7-3-1-4-8-17/h1-10H,11-14,16H2/p+1