2,2,2-tris(fluoranyl)ethyl 4-[(3-pyrrolidin-1-ylquinoxalin-2-yl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl 4-[(3-pyrrolidin-1-ylquinoxalin-2-yl)carbamoyl]piperidine-1-carboxylate Openeye Name: 2,2,2-trifluoroethyl 4-[(3-pyrrolidin-1-ylquinoxalin-2-yl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[[3-(1-pyrrolidinyl)-2-quinoxalinyl]amino]methyl]-1-piperidinecarboxylic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl 4-[(3-pyrrolidin-1-ylquinoxalin-2-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(3-pyrrolidinoquinoxalin-2-yl)carbamoyl]piperidine-1-carboxylic acid 2,2,2-trifluoroethyl ester Formula: C21H24F3N5O3 MolecularWeight: 451.44217

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)C4CCN(CC4)C(=O)OCC(F)(F)F

Isomeric SMILES

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)C4CCN(CC4)C(=O)OCC(F)(F)F

InChI

InChI=1S/C21H24F3N5O3/c22-21(23,24)13-32-20(31)29-11-7-14(8-12-29)19(30)27-17-18(28-9-3-4-10-28)26-16-6-2-1-5-15(16)25-17/h1-2,5-6,14H,3-4,7-13H2,(H,25,27,30)