ethyl 1-ethylsulfanylcarbonyl-2-phenyl-pyridin-1-ium-3-carboxylate

Systemtic Name: ethyl 1-ethylsulfanylcarbonyl-2-phenyl-pyridin-1-ium-3-carboxylate Openeye Name: ethyl 1-ethylsulfanylcarbonyl-2-phenyl-pyridin-1-ium-3-carboxylate CAS Name: 1-[(ethylthio)-oxomethyl]-2-phenyl-3-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethylsulfanylcarbonyl-2-phenylpyridin-1-ium-3-carboxylate Traditional Name: 1-(ethylthio)carbonyl-2-phenyl-pyridin-1-ium-3-carboxylic acid ethyl ester Formula: C17H18NO3S+ MolecularWeight: 316.39472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18NO3S/c1-3-21-16(19)14-11-8-12-18(17(20)22-4-2)15(14)13-9-6-5-7-10-13/h5-12H,3-4H2,1-2H3/q+1