2-oxidanylideneethyl 3-(4-fluorophenyl)-2-(2-pyridin-4-yloxiran-2-yl)piperidine-1-carboxylate

Systemtic Name: 2-oxidanylideneethyl 3-(4-fluorophenyl)-2-(2-pyridin-4-yloxiran-2-yl)piperidine-1-carboxylate Openeye Name: 2-oxoethyl 3-(4-fluorophenyl)-2-[2-(4-pyridyl)oxiran-2-yl]piperidine-1-carboxylate CAS Name: 3-(4-fluorophenyl)-2-(2-pyridin-4-yl-2-oxiranyl)-1-piperidinecarboxylic acid 2-oxoethyl ester IUPAC Name: 2-oxoethyl 3-(4-fluorophenyl)-2-(2-pyridin-4-yloxiran-2-yl)piperidine-1-carboxylate Traditional Name: 3-(4-fluorophenyl)-2-[2-(4-pyridyl)oxiran-2-yl]piperidine-1-carboxylic acid 2-ketoethyl ester Formula: C21H21FN2O4 MolecularWeight: 384.400843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(N(C1)C(=O)OCC=O)C2(CO2)C3=CC=NC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC(C(N(C1)C(=O)OCC=O)C2(CO2)C3=CC=NC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN2O4/c22-17-5-3-15(4-6-17)18-2-1-11-24(20(26)27-13-12-25)19(18)21(14-28-21)16-7-9-23-10-8-16/h3-10,12,18-19H,1-2,11,13-14H2