ethyl 1-[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxylate

Systemtic Name: ethyl 1-[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxylate Openeye Name: ethyl 1-[2-(3,4-dichlorophenyl)-2-oxo-ethyl]pyridin-1-ium-3-carboxylate CAS Name: 1-[2-(3,4-dichlorophenyl)-2-oxoethyl]-3-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3,4-dichlorophenyl)-2-oxoethyl]pyridin-1-ium-3-carboxylate Traditional Name: 1-[2-(3,4-dichlorophenyl)-2-keto-ethyl]pyridin-1-ium-3-carboxylic acid ethyl ester Formula: C16H14Cl2NO3+ MolecularWeight: 339.19326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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