ethyl 1-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[2-(4-fluorophenyl)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-(4-fluorophenyl)-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-fluorophenyl)-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-(4-fluorophenyl)-2-keto-ethyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C16H21FNO3+ MolecularWeight: 294.341243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H20FNO3/c1-2-21-16(20)13-7-9-18(10-8-13)11-15(19)12-3-5-14(17)6-4-12/h3-6,13H,2,7-11H2,1H3/p+1