methyl 1-[(3-fluorophenyl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[(3-fluorophenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[(3-fluorophenyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(3-fluorophenyl)methyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[(3-fluorophenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-(3-fluorobenzyl)piperidin-1-ium-4-carboxylic acid methyl ester Formula: C14H19FNO2+ MolecularWeight: 252.304563

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC[NH+](CC1)CC2=CC(=CC=C2)F

Isomeric SMILES

COC(=O)C1CC[NH+](CC1)CC2=CC(=CC=C2)F

InChI

InChI=1S/C14H18FNO2/c1-18-14(17)12-5-7-16(8-6-12)10-11-3-2-4-13(15)9-11/h2-4,9,12H,5-8,10H2,1H3/p+1