1-butyl-N-[4-chloranyl-3-(trifluoromethyl)phenyl]azepan-2-imine

Systemtic Name: 1-butyl-N-[4-chloranyl-3-(trifluoromethyl)phenyl]azepan-2-imine Openeye Name: 1-butyl-N-[4-chloro-3-(trifluoromethyl)phenyl]azepan-2-imine CAS Name: 1-butyl-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-azepanimine IUPAC Name: 1-butyl-N-[4-chloro-3-(trifluoromethyl)phenyl]azepan-2-imine Traditional Name: (1-butylazepan-2-ylidene)-[4-chloro-3-(trifluoromethyl)phenyl]amine Formula: C17H22ClF3N2 MolecularWeight: 346.81819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCCCC1=NC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CCCCN1CCCCCC1=NC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C17H22ClF3N2/c1-2-3-10-23-11-6-4-5-7-16(23)22-13-8-9-15(18)14(12-13)17(19,20)21/h8-9,12H,2-7,10-11H2,1H3