ethyl 1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-4-(oxan-2-ylmethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-4-(oxan-2-ylmethyl)piperidine-4-carboxylate Openeye Name: ethyl 1-[(2-fluoro-4-methoxy-phenyl)methyl]-4-(tetrahydropyran-2-ylmethyl)piperidine-4-carboxylate CAS Name: 1-[(2-fluoro-4-methoxyphenyl)methyl]-4-(2-oxanylmethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-fluoro-4-methoxyphenyl)methyl]-4-(oxan-2-ylmethyl)piperidine-4-carboxylate Traditional Name: 1-(2-fluoro-4-methoxy-benzyl)-4-(tetrahydropyran-2-ylmethyl)isonipecotic acid ethyl ester Formula: C22H32FNO4 MolecularWeight: 393.492183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=C(C=C(C=C2)OC)F)CC3CCCCO3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=C(C=C(C=C2)OC)F)CC3CCCCO3

InChI

InChI=1S/C22H32FNO4/c1-3-27-21(25)22(15-19-6-4-5-13-28-19)9-11-24(12-10-22)16-17-7-8-18(26-2)14-20(17)23/h7-8,14,19H,3-6,9-13,15-16H2,1-2H3