ethyl 4-[(3-fluorophenyl)methyl]-1-(2-hydroxyethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 4-[(3-fluorophenyl)methyl]-1-(2-hydroxyethyl)piperidin-1-ium-4-carboxylate Openeye Name: ethyl 4-[(3-fluorophenyl)methyl]-1-(2-hydroxyethyl)piperidin-1-ium-4-carboxylate CAS Name: 4-[(3-fluorophenyl)methyl]-1-(2-hydroxyethyl)-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-fluorophenyl)methyl]-1-(2-hydroxyethyl)piperidin-1-ium-4-carboxylate Traditional Name: 4-(3-fluorobenzyl)-1-(2-hydroxyethyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H25FNO3+ MolecularWeight: 310.383703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CCO)CC2=CC(=CC=C2)F

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CCO)CC2=CC(=CC=C2)F

InChI

InChI=1S/C17H24FNO3/c1-2-22-16(21)17(6-8-19(9-7-17)10-11-20)13-14-4-3-5-15(18)12-14/h3-5,12,20H,2,6-11,13H2,1H3/p+1