(E,2R)-4-phenyl-2-piperidin-1-ium-1-yl-but-3-enenitrile

Systemtic Name: (E,2R)-4-phenyl-2-piperidin-1-ium-1-yl-but-3-enenitrile Openeye Name: (E,2R)-4-phenyl-2-piperidin-1-ium-1-yl-but-3-enenitrile CAS Name: (E,2R)-4-phenyl-2-(1-piperidin-1-iumyl)-3-butenenitrile IUPAC Name: (E,2R)-4-phenyl-2-piperidin-1-ium-1-ylbut-3-enenitrile Traditional Name: (E,2R)-4-phenyl-2-piperidin-1-ium-1-yl-but-3-enenitrile Formula: C15H19N2+ MolecularWeight: 227.32476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(C=CC2=CC=CC=C2)C#N

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2/c16-13-15(17-11-5-2-6-12-17)10-9-14-7-3-1-4-8-14/h1,3-4,7-10,15H,2,5-6,11-12H2/p+1/b10-9+/t15-/m1/s1