ethyl 4-[(3-fluorophenyl)methyl]-1-[(2-methoxy-6-oxidanyl-phenyl)methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(3-fluorophenyl)methyl]-1-[(2-methoxy-6-oxidanyl-phenyl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 4-[(3-fluorophenyl)methyl]-1-[(2-hydroxy-6-methoxy-phenyl)methyl]piperidine-4-carboxylate CAS Name: 4-[(3-fluorophenyl)methyl]-1-[(2-hydroxy-6-methoxyphenyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-fluorophenyl)methyl]-1-[(2-hydroxy-6-methoxyphenyl)methyl]piperidine-4-carboxylate Traditional Name: 4-(3-fluorobenzyl)-1-(2-hydroxy-6-methoxy-benzyl)isonipecotic acid ethyl ester Formula: C23H28FNO4 MolecularWeight: 401.471123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=C(C=CC=C2OC)O)CC3=CC(=CC=C3)F

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=C(C=CC=C2OC)O)CC3=CC(=CC=C3)F

InChI

InChI=1S/C23H28FNO4/c1-3-29-22(27)23(15-17-6-4-7-18(24)14-17)10-12-25(13-11-23)16-19-20(26)8-5-9-21(19)28-2/h4-9,14,26H,3,10-13,15-16H2,1-2H3