N-[2-(azepan-1-yl)phenyl]-2-[2-oxidanylidene-3-(trifluoromethyl)pyridin-1-yl]ethanamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-2-[2-oxidanylidene-3-(trifluoromethyl)pyridin-1-yl]ethanamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridyl]acetamide CAS Name: N-[2-(1-azepanyl)phenyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-2-[2-oxo-3-(trifluoromethyl)pyridin-1-yl]acetamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-2-[2-keto-3-(trifluoromethyl)-1-pyridyl]acetamide Formula: C20H22F3N3O2 MolecularWeight: 393.40279

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)CN3C=CC=C(C3=O)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)CN3C=CC=C(C3=O)C(F)(F)F

InChI

InChI=1S/C20H22F3N3O2/c21-20(22,23)15-8-7-13-26(19(15)28)14-18(27)24-16-9-3-4-10-17(16)25-11-5-1-2-6-12-25/h3-4,7-10,13H,1-2,5-6,11-12,14H2,(H,24,27)