2,2,2-tris(fluoranyl)ethyl 4-[(2-methyl-4-pyrrolidin-1-yl-phenyl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl 4-[(2-methyl-4-pyrrolidin-1-yl-phenyl)carbamoyl]piperidine-1-carboxylate Openeye Name: 2,2,2-trifluoroethyl 4-[(2-methyl-4-pyrrolidin-1-yl-phenyl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[2-methyl-4-(1-pyrrolidinyl)anilino]-oxomethyl]-1-piperidinecarboxylic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl 4-[(2-methyl-4-pyrrolidin-1-ylphenyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(2-methyl-4-pyrrolidino-phenyl)carbamoyl]piperidine-1-carboxylic acid 2,2,2-trifluoroethyl ester Formula: C20H26F3N3O3 MolecularWeight: 413.43395

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3CCN(CC3)C(=O)OCC(F)(F)F

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3CCN(CC3)C(=O)OCC(F)(F)F

InChI

InChI=1S/C20H26F3N3O3/c1-14-12-16(25-8-2-3-9-25)4-5-17(14)24-18(27)15-6-10-26(11-7-15)19(28)29-13-20(21,22)23/h4-5,12,15H,2-3,6-11,13H2,1H3,(H,24,27)