azepan-1-yl-[1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazol-3-yl]methanone Openeye Name: azepan-1-yl-[1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazol-3-yl]methanone CAS Name: 1-azepanyl-[1-[[3-(trifluoromethyl)phenoxy]methyl]-3-pyrazolyl]methanone IUPAC Name: azepan-1-yl-[1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazol-3-yl]methanone Traditional Name: azepan-1-yl-[1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazol-3-yl]methanone Formula: C18H20F3N3O2 MolecularWeight: 367.36551

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=NN(C=C2)COC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=NN(C=C2)COC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H20F3N3O2/c19-18(20,21)14-6-5-7-15(12-14)26-13-24-11-8-16(22-24)17(25)23-9-3-1-2-4-10-23/h5-8,11-12H,1-4,9-10,13H2