4-[[3-(trifluoromethyl)-1H-pyrazol-5-yl]methyl]-1,4-oxazepane

Systemtic Name: 4-[[3-(trifluoromethyl)-1H-pyrazol-5-yl]methyl]-1,4-oxazepane Openeye Name: 4-[[3-(trifluoromethyl)-1H-pyrazol-5-yl]methyl]-1,4-oxazepane CAS Name: 4-[[3-(trifluoromethyl)-1H-pyrazol-5-yl]methyl]-1,4-oxazepane IUPAC Name: 4-[[3-(trifluoromethyl)-1H-pyrazol-5-yl]methyl]-1,4-oxazepane Traditional Name: 4-[[3-(trifluoromethyl)-1H-pyrazol-5-yl]methyl]-1,4-oxazepane Formula: C10H14F3N3O MolecularWeight: 249.23287

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCOC1)CC2=CC(=NN2)C(F)(F)F

Isomeric SMILES

C1CN(CCOC1)CC2=CC(=NN2)C(F)(F)F

InChI

InChI=1S/C10H14F3N3O/c11-10(12,13)9-6-8(14-15-9)7-16-2-1-4-17-5-3-16/h6H,1-5,7H2,(H,14,15)