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

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-N,N-diethyl-pyridin-1-ium-4-carboxamide chloride Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-N,N-diethyl-pyridin-1-ium-4-carboxamide chloride CAS Name: 1-[(3,4-dichlorophenyl)methyl]-N,N-diethyl-4-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-N,N-diethylpyridin-1-ium-4-carboxamide chloride Traditional Name: 1-(3,4-dichlorobenzyl)-N,N-diethyl-pyridin-1-ium-4-carboxamide chloride Formula: C17H19Cl3N2O MolecularWeight: 373.70456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19Cl2N2O.ClH/c1-3-21(4-2)17(22)14-7-9-20(10-8-14)12-13-5-6-15(18)16(19)11-13;/h5-11H,3-4,12H2,1-2H3;1H/q+1;/p-1