1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]azepan-2-one

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]azepan-2-one Openeye Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]azepan-2-one CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-azepanone IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]azepan-2-one Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]azepan-2-one Formula: C12H12ClF3N2O MolecularWeight: 292.68469

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

C1CCC(=O)N(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C12H12ClF3N2O/c13-9-6-8(12(14,15)16)7-17-11(9)18-5-3-1-2-4-10(18)19/h6-7H,1-5H2