ethyl 1-[3-(4-fluorophenyl)-3-oxidanylidene-propyl]-4-phenyl-piperidin-1-ium-4-carboxylate chloride

Systemtic Name: ethyl 1-[3-(4-fluorophenyl)-3-oxidanylidene-propyl]-4-phenyl-piperidin-1-ium-4-carboxylate chloride Openeye Name: ethyl 1-[3-(4-fluorophenyl)-3-oxo-propyl]-4-phenyl-piperidin-1-ium-4-carboxylate chloride CAS Name: 1-[3-(4-fluorophenyl)-3-oxopropyl]-4-phenyl-4-piperidin-1-iumcarboxylic acid ethyl ester chloride IUPAC Name: ethyl 1-[3-(4-fluorophenyl)-3-oxopropyl]-4-phenylpiperidin-1-ium-4-carboxylate chloride Traditional Name: 1-[3-(4-fluorophenyl)-3-keto-propyl]-4-phenyl-piperidin-1-ium-4-carboxylic acid ethyl ester chloride Formula: C23H27ClFNO3 MolecularWeight: 419.916783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C23H26FNO3.ClH/c1-2-28-22(27)23(19-6-4-3-5-7-19)13-16-25(17-14-23)15-12-21(26)18-8-10-20(24)11-9-18;/h3-11H,2,12-17H2,1H3;1H