1-[4-butylsulfonyl-2-(4-chloranyl-2-fluoranyl-phenoxy)-5-fluoranyl-phenyl]-N-methyl-methanamine

Systemtic Name: 1-[4-butylsulfonyl-2-(4-chloranyl-2-fluoranyl-phenoxy)-5-fluoranyl-phenyl]-N-methyl-methanamine Openeye Name: 1-[4-butylsulfonyl-2-(4-chloro-2-fluoro-phenoxy)-5-fluoro-phenyl]-N-methyl-methanamine CAS Name: 1-[4-butylsulfonyl-2-(4-chloro-2-fluorophenoxy)-5-fluorophenyl]-N-methylmethanamine IUPAC Name: 1-[4-butylsulfonyl-2-(4-chloro-2-fluorophenoxy)-5-fluorophenyl]-N-methylmethanamine Traditional Name: [4-butylsulfonyl-2-(4-chloro-2-fluoro-phenoxy)-5-fluoro-benzyl]-methyl-amine Formula: C18H20ClF2NO3S MolecularWeight: 403.871106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=C(C=C(C(=C1)OC2=C(C=C(C=C2)Cl)F)CNC)F

Isomeric SMILES

CCCCS(=O)(=O)C1=C(C=C(C(=C1)OC2=C(C=C(C=C2)Cl)F)CNC)F

InChI

InChI=1S/C18H20ClF2NO3S/c1-3-4-7-26(23,24)18-10-17(12(11-22-2)8-15(18)21)25-16-6-5-13(19)9-14(16)20/h5-6,8-10,22H,3-4,7,11H2,1-2H3