O3-[[(3S,4R)-4-(4-fluorophenyl)-1-phenoxycarbonyl-piperidin-3-yl]methyl] O1-methyl propanedioate

Systemtic Name: O3-[[(3S,4R)-4-(4-fluorophenyl)-1-phenoxycarbonyl-piperidin-3-yl]methyl] O1-methyl propanedioate Openeye Name: O3-[[(3S,4R)-4-(4-fluorophenyl)-1-phenoxycarbonyl-3-piperidyl]methyl] O1-methyl propanedioate CAS Name: propanedioic acid O3-[[(3S,4R)-4-(4-fluorophenyl)-1-[oxo(phenoxy)methyl]-3-piperidinyl]methyl] ester O1-methyl ester IUPAC Name: 3-O-[[(3S,4R)-4-(4-fluorophenyl)-1-phenoxycarbonylpiperidin-3-yl]methyl] 1-O-methyl propanedioate Traditional Name: malonic acid O3-[[(3S,4R)-1-carbophenoxy-4-(4-fluorophenyl)-3-piperidyl]methyl] ester O1-methyl ester Formula: C23H24FNO6 MolecularWeight: 429.438163

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)OCC1CN(CCC1C2=CC=C(C=C2)F)C(=O)OC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC(=O)OC[C@@H]1CN(CC[C@H]1C2=CC=C(C=C2)F)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C23H24FNO6/c1-29-21(26)13-22(27)30-15-17-14-25(23(28)31-19-5-3-2-4-6-19)12-11-20(17)16-7-9-18(24)10-8-16/h2-10,17,20H,11-15H2,1H3/t17-,20-/m0/s1