N-(3-pyrrolidin-1-ylquinoxalin-2-yl)-1-[4-(trifluoromethyl)phenyl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-pyrrolidin-1-ylquinoxalin-2-yl)-1-[4-(trifluoromethyl)phenyl]carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-pyrrolidin-1-ylquinoxalin-2-yl)-1-[4-(trifluoromethyl)benzoyl]piperidine-4-carboxamide CAS Name: 1-[oxo-[4-(trifluoromethyl)phenyl]methyl]-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]-4-piperidinecarboxamide IUPAC Name: N-(3-pyrrolidin-1-ylquinoxalin-2-yl)-1-[4-(trifluoromethyl)benzoyl]piperidine-4-carboxamide Traditional Name: N-(3-pyrrolidinoquinoxalin-2-yl)-1-[4-(trifluoromethyl)benzoyl]isonipecotamide Formula: C26H26F3N5O2 MolecularWeight: 497.51215

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)C4CCN(CC4)C(=O)C5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)C4CCN(CC4)C(=O)C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C26H26F3N5O2/c27-26(28,29)19-9-7-18(8-10-19)25(36)34-15-11-17(12-16-34)24(35)32-22-23(33-13-3-4-14-33)31-21-6-2-1-5-20(21)30-22/h1-2,5-10,17H,3-4,11-16H2,(H,30,32,35)