1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N,N-dimethyl-pyridin-1-ium-3-carboxamide chloride

Systemtic Name: 1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N,N-dimethyl-pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-[2-(4-chloroanilino)-2-oxo-ethyl]-N,N-dimethyl-pyridin-1-ium-3-carboxamide chloride CAS Name: 1-[2-(4-chloroanilino)-2-oxoethyl]-N,N-dimethyl-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[2-(4-chloroanilino)-2-oxoethyl]-N,N-dimethylpyridin-1-ium-3-carboxamide chloride Traditional Name: 1-[2-(4-chloroanilino)-2-keto-ethyl]-N,N-dimethyl-pyridin-1-ium-3-carboxamide chloride Formula: C16H17Cl2N3O2 MolecularWeight: 354.23108

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=C[N+](=CC=C1)CC(=O)NC2=CC=C(C=C2)Cl.[Cl-]

Isomeric SMILES

CN(C)C(=O)C1=C[N+](=CC=C1)CC(=O)NC2=CC=C(C=C2)Cl.[Cl-]

InChI

InChI=1S/C16H16ClN3O2.ClH/c1-19(2)16(22)12-4-3-9-20(10-12)11-15(21)18-14-7-5-13(17)6-8-14;/h3-10H,11H2,1-2H3;1H