N-ethyl-N'-[[2-(1-phenoxyethylsulfonyl)phenyl]methyl]propane-1,3-diamine

Systemtic Name: N-ethyl-N'-[[2-(1-phenoxyethylsulfonyl)phenyl]methyl]propane-1,3-diamine Openeye Name: N-ethyl-N'-[[2-(1-phenoxyethylsulfonyl)phenyl]methyl]propane-1,3-diamine CAS Name: N-ethyl-N'-[[2-(1-phenoxyethylsulfonyl)phenyl]methyl]propane-1,3-diamine IUPAC Name: N-ethyl-N'-[[2-(1-phenoxyethylsulfonyl)phenyl]methyl]propane-1,3-diamine Traditional Name: ethyl-[3-[[2-(1-phenoxyethylsulfonyl)benzyl]amino]propyl]amine Formula: C20H28N2O3S MolecularWeight: 376.51292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNCCCNCC1=CC=CC=C1S(=O)(=O)C(C)OC2=CC=CC=C2

Isomeric SMILES

CCNCCCNCC1=CC=CC=C1S(=O)(=O)C(C)OC2=CC=CC=C2

InChI

InChI=1S/C20H28N2O3S/c1-3-21-14-9-15-22-16-18-10-7-8-13-20(18)26(23,24)17(2)25-19-11-5-4-6-12-19/h4-8,10-13,17,21-22H,3,9,14-16H2,1-2H3