(2S)-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-N-methyl-N-[2-(4-pyridyl)ethyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-N-methyl-N-(2-pyridin-4-ylethyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-N-methyl-N-[2-(4-pyridyl)ethyl]pyrrolidin-1-ium-2-carboxamide Formula: C13H20N3O+ MolecularWeight: 234.3174

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=NC=C1)C(=O)C2CCC[NH2+]2

Isomeric SMILES

CN(CCC1=CC=NC=C1)C(=O)[C@@H]2CCC[NH2+]2

InChI

InChI=1S/C13H19N3O/c1-16(13(17)12-3-2-7-15-12)10-6-11-4-8-14-9-5-11/h4-5,8-9,12,15H,2-3,6-7,10H2,1H3/p+1/t12-/m0/s1