N-(3-chloranyl-4-fluoranyl-phenyl)-1-(3-ethoxyquinoxalin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-1-(3-ethoxyquinoxalin-2-yl)piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-1-(3-ethoxyquinoxalin-2-yl)piperidine-4-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-1-(3-ethoxy-2-quinoxalinyl)-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-1-(3-ethoxyquinoxalin-2-yl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-1-(3-ethoxyquinoxalin-2-yl)isonipecotamide Formula: C22H22ClFN4O2 MolecularWeight: 428.887083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=CC=CC=C2N=C1N3CCC(CC3)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CCOC1=NC2=CC=CC=C2N=C1N3CCC(CC3)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H22ClFN4O2/c1-2-30-22-20(26-18-5-3-4-6-19(18)27-22)28-11-9-14(10-12-28)21(29)25-15-7-8-17(24)16(23)13-15/h3-8,13-14H,2,9-12H2,1H3,(H,25,29)