6-methoxy-7-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-azepine

Systemtic Name: 6-methoxy-7-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-azepine Openeye Name: 6-methoxy-7-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-azepine CAS Name: 6-methoxy-7-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-azepine IUPAC Name: 6-methoxy-7-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-azepine Traditional Name: 6-methoxy-7-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-azepine Formula: C8H12F3NO MolecularWeight: 195.18219

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(NCCCC1)C(F)(F)F

Isomeric SMILES

COC1=C(NCCCC1)C(F)(F)F

InChI

InChI=1S/C8H12F3NO/c1-13-6-4-2-3-5-12-7(6)8(9,10)11/h12H,2-5H2,1H3