1-[(4-chlorophenyl)methyl]-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride

Systemtic Name: 1-[(4-chlorophenyl)methyl]-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-[(4-chlorophenyl)methyl]-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride CAS Name: 1-[(4-chlorophenyl)methyl]-N,N-diethyl-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[(4-chlorophenyl)methyl]-N,N-diethylpyridin-1-ium-3-carboxamide chloride Traditional Name: 1-(4-chlorobenzyl)-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride Formula: C17H20Cl2N2O MolecularWeight: 339.2595

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C[N+](=CC=C1)CC2=CC=C(C=C2)Cl.[Cl-]

Isomeric SMILES

CCN(CC)C(=O)C1=C[N+](=CC=C1)CC2=CC=C(C=C2)Cl.[Cl-]

InChI

InChI=1S/C17H20ClN2O.ClH/c1-3-20(4-2)17(21)15-6-5-11-19(13-15)12-14-7-9-16(18)10-8-14;/h5-11,13H,3-4,12H2,1-2H3;1H/q+1;/p-1