N-(2-oxidanylideneazepan-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide

Systemtic Name: N-(2-oxidanylideneazepan-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide Openeye Name: N-(2-oxoazepan-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide CAS Name: N-(2-oxo-3-azepanyl)-6-(trifluoromethyl)-3-pyridinecarboxamide IUPAC Name: N-(2-oxoazepan-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide Traditional Name: N-(2-ketoazepan-3-yl)-6-(trifluoromethyl)nicotinamide Formula: C13H14F3N3O2 MolecularWeight: 301.26437

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=CN=C(C=C2)C(F)(F)F

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)C2=CN=C(C=C2)C(F)(F)F

InChI

InChI=1S/C13H14F3N3O2/c14-13(15,16)10-5-4-8(7-18-10)11(20)19-9-3-1-2-6-17-12(9)21/h4-5,7,9H,1-3,6H2,(H,17,21)(H,19,20)