(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate CAS Name: 4-methoxy-1-[3-(trifluoromethyl)phenyl]-3-pyrazolecarboxylic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Traditional Name: 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C18H18F3N3O4 MolecularWeight: 397.34843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)OCC(=O)N2CCCC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CN(N=C1C(=O)OCC(=O)N2CCCC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H18F3N3O4/c1-27-14-10-24(13-6-4-5-12(9-13)18(19,20)21)22-16(14)17(26)28-11-15(25)23-7-2-3-8-23/h4-6,9-10H,2-3,7-8,11H2,1H3