2-[2-oxidanylidene-6-[3,3,3-tris(fluoranyl)propyl]azepan-1-yl]butanamide

Systemtic Name: 2-[2-oxidanylidene-6-[3,3,3-tris(fluoranyl)propyl]azepan-1-yl]butanamide Openeye Name: 2-[2-oxo-6-(3,3,3-trifluoropropyl)azepan-1-yl]butanamide CAS Name: 2-[2-oxo-6-(3,3,3-trifluoropropyl)-1-azepanyl]butanamide IUPAC Name: 2-[2-oxo-6-(3,3,3-trifluoropropyl)azepan-1-yl]butanamide Traditional Name: 2-[2-keto-6-(3,3,3-trifluoropropyl)azepan-1-yl]butyramide Formula: C13H21F3N2O2 MolecularWeight: 294.31325

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N)N1CC(CCCC1=O)CCC(F)(F)F

Isomeric SMILES

CCC(C(=O)N)N1CC(CCCC1=O)CCC(F)(F)F

InChI

InChI=1S/C13H21F3N2O2/c1-2-10(12(17)20)18-8-9(4-3-5-11(18)19)6-7-13(14,15)16/h9-10H,2-8H2,1H3,(H2,17,20)