methyl (3S,4R)-4-(4-fluorophenyl)-2-oxidanylidene-1-(phenylmethyl)piperidine-3-carboxylate

Systemtic Name: methyl (3S,4R)-4-(4-fluorophenyl)-2-oxidanylidene-1-(phenylmethyl)piperidine-3-carboxylate Openeye Name: methyl (3S,4R)-1-benzyl-4-(4-fluorophenyl)-2-oxo-piperidine-3-carboxylate CAS Name: (3S,4R)-4-(4-fluorophenyl)-2-oxo-1-(phenylmethyl)-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-1-benzyl-4-(4-fluorophenyl)-2-oxopiperidine-3-carboxylate Traditional Name: (3S,4R)-1-benzyl-4-(4-fluorophenyl)-2-keto-nipecotic acid methyl ester Formula: C20H20FNO3 MolecularWeight: 341.376103

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(CCN(C1=O)CC2=CC=CC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)[C@H]1[C@@H](CCN(C1=O)CC2=CC=CC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H20FNO3/c1-25-20(24)18-17(15-7-9-16(21)10-8-15)11-12-22(19(18)23)13-14-5-3-2-4-6-14/h2-10,17-18H,11-13H2,1H3/t17-,18-/m0/s1