N-methyl-N-phenethyl-3-(phenylsulfonyl)propan-1-amine

Systemtic Name: N-methyl-N-phenethyl-3-(phenylsulfonyl)propan-1-amine Openeye Name: 3-(benzenesulfonyl)-N-methyl-N-phenethyl-propan-1-amine CAS Name: 3-(benzenesulfonyl)-N-methyl-N-phenethyl-1-propanamine IUPAC Name: 3-(benzenesulfonyl)-N-methyl-N-phenethylpropan-1-amine Traditional Name: 3-besylpropyl-methyl-phenethyl-amine Formula: C18H23NO2S MolecularWeight: 317.44572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCS(=O)(=O)C1=CC=CC=C1)CCC2=CC=CC=C2

Isomeric SMILES

CN(CCCS(=O)(=O)C1=CC=CC=C1)CCC2=CC=CC=C2

InChI

InChI=1S/C18H23NO2S/c1-19(15-13-17-9-4-2-5-10-17)14-8-16-22(20,21)18-11-6-3-7-12-18/h2-7,9-12H,8,13-16H2,1H3