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

Systemtic Name: 1-[pyridin-2-yl-[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Openeye Name: 1-[2-pyridyl-[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane CAS Name: 1-[2-pyridinyl-[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane IUPAC Name: 1-[pyridin-2-yl-[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Traditional Name: 1-[2-pyridyl-[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Formula: C18H20F3N3 MolecularWeight: 335.36671

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC=CC=N3

Isomeric SMILES

C1CNCCN(C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC=CC=N3

InChI

InChI=1S/C18H20F3N3/c19-18(20,21)15-7-5-14(6-8-15)17(16-4-1-2-10-23-16)24-12-3-9-22-11-13-24/h1-2,4-8,10,17,22H,3,9,11-13H2