ethyl (3R)-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3R)-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-1-[(2-chloro-6-fluoro-phenyl)methyl]piperidin-1-ium-3-carboxylate CAS Name: (3R)-1-[(2-chloro-6-fluorophenyl)methyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-[(2-chloro-6-fluorophenyl)methyl]piperidin-1-ium-3-carboxylate Traditional Name: (3R)-1-(2-chloro-6-fluoro-benzyl)piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C15H20ClFNO2+ MolecularWeight: 300.776203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

CCOC(=O)[C@@H]1CCC[NH+](C1)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C15H19ClFNO2/c1-2-20-15(19)11-5-4-8-18(9-11)10-12-13(16)6-3-7-14(12)17/h3,6-7,11H,2,4-5,8-10H2,1H3/p+1/t11-/m1/s1