1-ethyl-4-(pyridin-2-ylmethylamino)piperidin-1-ium-4-carbonitrile

Systemtic Name: 1-ethyl-4-(pyridin-2-ylmethylamino)piperidin-1-ium-4-carbonitrile Openeye Name: 1-ethyl-4-(2-pyridylmethylamino)piperidin-1-ium-4-carbonitrile CAS Name: 1-ethyl-4-(2-pyridinylmethylamino)-4-piperidin-1-iumcarbonitrile IUPAC Name: 1-ethyl-4-(pyridin-2-ylmethylamino)piperidin-1-ium-4-carbonitrile Traditional Name: 1-ethyl-4-(2-pyridylmethylamino)piperidin-1-ium-4-carbonitrile Formula: C14H21N4+ MolecularWeight: 245.34334

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)(C#N)NCC2=CC=CC=N2

Isomeric SMILES

CC[NH+]1CCC(CC1)(C#N)NCC2=CC=CC=N2

InChI

InChI=1S/C14H20N4/c1-2-18-9-6-14(12-15,7-10-18)17-11-13-5-3-4-8-16-13/h3-5,8,17H,2,6-7,9-11H2,1H3/p+1