[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: [2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: [2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl] 1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid [2-(3,5-dimethylpiperidino)-2-keto-ethyl] ester Formula: C22H27FN2O3 MolecularWeight: 386.459783

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)COC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)F)C)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)COC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)F)C)C

InChI

InChI=1S/C22H27FN2O3/c1-14-9-15(2)12-24(11-14)21(26)13-28-22(27)20-10-16(3)25(17(20)4)19-7-5-18(23)6-8-19/h5-8,10,14-15H,9,11-13H2,1-4H3