3-methyl-4-[2-(trifluoromethyl)phenoxy]azepane

Systemtic Name: 3-methyl-4-[2-(trifluoromethyl)phenoxy]azepane Openeye Name: 3-methyl-4-[2-(trifluoromethyl)phenoxy]azepane CAS Name: 3-methyl-4-[2-(trifluoromethyl)phenoxy]azepane IUPAC Name: 3-methyl-4-[2-(trifluoromethyl)phenoxy]azepane Traditional Name: 3-methyl-4-[2-(trifluoromethyl)phenoxy]azepane Formula: C14H18F3NO MolecularWeight: 273.29403

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCCC1OC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC1CNCCCC1OC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C14H18F3NO/c1-10-9-18-8-4-7-12(10)19-13-6-3-2-5-11(13)14(15,16)17/h2-3,5-6,10,12,18H,4,7-9H2,1H3