(3S)-N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(2-cyanoethyl)-N-(3-pyridylmethyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(2-cyanoethyl)-N-(3-pyridinylmethyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(2-cyanoethyl)-N-(3-pyridylmethyl)piperidin-1-ium-3-carboxamide Formula: C15H21N4O+ MolecularWeight: 273.35344

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)C(=O)N(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)C(=O)N(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C15H20N4O/c16-6-3-9-19(12-13-4-1-7-17-10-13)15(20)14-5-2-8-18-11-14/h1,4,7,10,14,18H,2-3,5,8-9,11-12H2/p+1/t14-/m0/s1