1-[3-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane

Systemtic Name: 1-[3-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane Openeye Name: 1-[3-(trifluoromethyl)-2-pyridyl]-1,4-diazepane CAS Name: 1-[3-(trifluoromethyl)-2-pyridinyl]-1,4-diazepane IUPAC Name: 1-[3-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane Traditional Name: 1-[3-(trifluoromethyl)-2-pyridyl]-1,4-diazepane Formula: C11H14F3N3 MolecularWeight: 245.24417

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=C(C=CC=N2)C(F)(F)F

Isomeric SMILES

C1CNCCN(C1)C2=C(C=CC=N2)C(F)(F)F

InChI

InChI=1S/C11H14F3N3/c12-11(13,14)9-3-1-5-16-10(9)17-7-2-4-15-6-8-17/h1,3,5,15H,2,4,6-8H2