N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-1-ethyl-pyrazole-4-carboxamide

Systemtic Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-1-ethyl-pyrazole-4-carboxamide Openeye Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-1-ethyl-pyrazole-4-carboxamide CAS Name: N-[[2-(diethylamino)-3-pyridin-1-iumyl]methyl]-1-ethyl-4-pyrazolecarboxamide IUPAC Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-1-ethylpyrazole-4-carboxamide Traditional Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-1-ethyl-pyrazole-4-carboxamide Formula: C16H24N5O+ MolecularWeight: 302.39466

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C(=O)NCC2=C([NH+]=CC=C2)N(CC)CC

Isomeric SMILES

CCN1C=C(C=N1)C(=O)NCC2=C([NH+]=CC=C2)N(CC)CC

InChI

InChI=1S/C16H23N5O/c1-4-20(5-2)15-13(8-7-9-17-15)10-18-16(22)14-11-19-21(6-3)12-14/h7-9,11-12H,4-6,10H2,1-3H3,(H,18,22)/p+1