N-[2,4-bis(fluoranyl)phenyl]-1-(1-tert-butyl-5-oxidanylidene-pyrrolidin-3-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-1-(1-tert-butyl-5-oxidanylidene-pyrrolidin-3-yl)carbonyl-piperidine-4-carboxamide Openeye Name: 1-(1-tert-butyl-5-oxo-pyrrolidine-3-carbonyl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide CAS Name: 1-[(1-tert-butyl-5-oxo-3-pyrrolidinyl)-oxomethyl]-N-(2,4-difluorophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(1-tert-butyl-5-oxopyrrolidine-3-carbonyl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide Traditional Name: 1-(1-tert-butyl-5-keto-pyrrolidine-3-carbonyl)-N-(2,4-difluorophenyl)isonipecotamide Formula: C21H27F2N3O3 MolecularWeight: 407.454186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC(CC1=O)C(=O)N2CCC(CC2)C(=O)NC3=C(C=C(C=C3)F)F

Isomeric SMILES

CC(C)(C)N1CC(CC1=O)C(=O)N2CCC(CC2)C(=O)NC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C21H27F2N3O3/c1-21(2,3)26-12-14(10-18(26)27)20(29)25-8-6-13(7-9-25)19(28)24-17-5-4-15(22)11-16(17)23/h4-5,11,13-14H,6-10,12H2,1-3H3,(H,24,28)