2-[4-(trifluoromethyl)phenyl]ethanoyl 4-ethanoyl-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate

Systemtic Name: 2-[4-(trifluoromethyl)phenyl]ethanoyl 4-ethanoyl-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate Openeye Name: [2-[4-(trifluoromethyl)phenyl]acetyl] 4-acetyl-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate CAS Name: 4-acetyl-3-(1-pyrrolidinylmethyl)-1-piperazinecarboxylic acid [1-oxo-2-[4-(trifluoromethyl)phenyl]ethyl] ester IUPAC Name: [2-[4-(trifluoromethyl)phenyl]acetyl] 4-acetyl-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate Traditional Name: 4-acetyl-3-(pyrrolidinomethyl)piperazine-1-carboxylic acid [2-[4-(trifluoromethyl)phenyl]acetyl] ester Formula: C21H26F3N3O4 MolecularWeight: 441.44405

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1CN2CCCC2)C(=O)OC(=O)CC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(=O)N1CCN(CC1CN2CCCC2)C(=O)OC(=O)CC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H26F3N3O4/c1-15(28)27-11-10-26(14-18(27)13-25-8-2-3-9-25)20(30)31-19(29)12-16-4-6-17(7-5-16)21(22,23)24/h4-7,18H,2-3,8-14H2,1H3