N-(4-bromanyl-2-fluoranyl-phenyl)-1-quinoxalin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-quinoxalin-2-yl-piperidine-3-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-quinoxalin-2-yl-piperidine-3-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-(2-quinoxalinyl)-3-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-quinoxalin-2-ylpiperidine-3-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-quinoxalin-2-yl-nipecotamide Formula: C20H18BrFN4O MolecularWeight: 429.285523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC3=CC=CC=C3N=C2)C(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1CC(CN(C1)C2=NC3=CC=CC=C3N=C2)C(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C20H18BrFN4O/c21-14-7-8-16(15(22)10-14)25-20(27)13-4-3-9-26(12-13)19-11-23-17-5-1-2-6-18(17)24-19/h1-2,5-8,10-11,13H,3-4,9,12H2,(H,25,27)