ethyl 1-[2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-carboxylate Openeye Name: ethyl 1-[2-(2,4-dichlorophenyl)-2-oxo-ethyl]pyridin-1-ium-4-carboxylate CAS Name: 1-[2-(2,4-dichlorophenyl)-2-oxoethyl]-4-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2,4-dichlorophenyl)-2-oxoethyl]pyridin-1-ium-4-carboxylate Traditional Name: 1-[2-(2,4-dichlorophenyl)-2-keto-ethyl]pyridin-1-ium-4-carboxylic acid ethyl ester Formula: C16H14Cl2NO3+ MolecularWeight: 339.19326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=[N+](C=C1)CC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CC=[N+](C=C1)CC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H14Cl2NO3/c1-2-22-16(21)11-5-7-19(8-6-11)10-15(20)13-4-3-12(17)9-14(13)18/h3-9H,2,10H2,1H3/q+1