ethyl (3R)-3-[(2-fluorophenyl)methyl]-1-(2-imidazol-1-ylethanoyl)piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-3-[(2-fluorophenyl)methyl]-1-(2-imidazol-1-ylethanoyl)piperidine-3-carboxylate Openeye Name: ethyl (3R)-3-[(2-fluorophenyl)methyl]-1-(2-imidazol-1-ylacetyl)piperidine-3-carboxylate CAS Name: (3R)-3-[(2-fluorophenyl)methyl]-1-[2-(1-imidazolyl)-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-[(2-fluorophenyl)methyl]-1-(2-imidazol-1-ylacetyl)piperidine-3-carboxylate Traditional Name: (3R)-3-(2-fluorobenzyl)-1-(2-imidazol-1-ylacetyl)nipecotic acid ethyl ester Formula: C20H24FN3O3 MolecularWeight: 373.421263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)CN2C=CN=C2)CC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)[C@]1(CCCN(C1)C(=O)CN2C=CN=C2)CC3=CC=CC=C3F

InChI

InChI=1S/C20H24FN3O3/c1-2-27-19(26)20(12-16-6-3-4-7-17(16)21)8-5-10-24(14-20)18(25)13-23-11-9-22-15-23/h3-4,6-7,9,11,15H,2,5,8,10,12-14H2,1H3/t20-/m1/s1