2-ethyl-N-[[2-(2-methylsulfonylphenyl)phenyl]-phenyl-methyl]hexan-1-amine

Systemtic Name: 2-ethyl-N-[[2-(2-methylsulfonylphenyl)phenyl]-phenyl-methyl]hexan-1-amine Openeye Name: 2-ethyl-N-[[2-(2-methylsulfonylphenyl)phenyl]-phenyl-methyl]hexan-1-amine CAS Name: 2-ethyl-N-[[2-(2-methylsulfonylphenyl)phenyl]-phenylmethyl]-1-hexanamine IUPAC Name: 2-ethyl-N-[[2-(2-methylsulfonylphenyl)phenyl]-phenylmethyl]hexan-1-amine Traditional Name: 2-ethylhexyl-[[2-(2-mesylphenyl)phenyl]-phenyl-methyl]amine Formula: C28H35NO2S MolecularWeight: 449.648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(C1=CC=CC=C1)C2=CC=CC=C2C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CCCCC(CC)CNC(C1=CC=CC=C1)C2=CC=CC=C2C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C28H35NO2S/c1-4-6-14-22(5-2)21-29-28(23-15-8-7-9-16-23)26-19-11-10-17-24(26)25-18-12-13-20-27(25)32(3,30)31/h7-13,15-20,22,28-29H,4-6,14,21H2,1-3H3