1-(2-azanyl-2-oxidanylidene-ethyl)-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride

Systemtic Name: 1-(2-azanyl-2-oxidanylidene-ethyl)-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-(2-amino-2-oxo-ethyl)-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride CAS Name: 1-(2-amino-2-oxoethyl)-N,N-diethyl-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-(2-amino-2-oxoethyl)-N,N-diethylpyridin-1-ium-3-carboxamide chloride Traditional Name: 1-(2-amino-2-keto-ethyl)-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride Formula: C12H18ClN3O2 MolecularWeight: 271.74322

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C[N+](=CC=C1)CC(=O)N.[Cl-]

Isomeric SMILES

CCN(CC)C(=O)C1=C[N+](=CC=C1)CC(=O)N.[Cl-]

InChI

InChI=1S/C12H17N3O2.ClH/c1-3-15(4-2)12(17)10-6-5-7-14(8-10)9-11(13)16;/h5-8H,3-4,9H2,1-2H3,(H-,13,16);1H