2-[4-(2-phosphonatoethylsulfonyl)phenyl]ethanamine

Systemtic Name: 2-[4-(2-phosphonatoethylsulfonyl)phenyl]ethanamine Openeye Name: 2-[4-(2-phosphonatoethylsulfonyl)phenyl]ethanamine CAS Name: 2-[4-(2-phosphonatoethylsulfonyl)phenyl]ethanamine IUPAC Name: 2-[4-(2-phosphonatoethylsulfonyl)phenyl]ethanamine Traditional Name: 2-[4-(2-phosphonatoethylsulfonyl)phenyl]ethylamine Formula: C10H14NO5PS-2 MolecularWeight: 291.260621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCN)S(=O)(=O)CCP(=O)([O-])[O-]

Isomeric SMILES

C1=CC(=CC=C1CCN)S(=O)(=O)CCP(=O)([O-])[O-]

InChI

InChI=1S/C10H16NO5PS/c11-6-5-9-1-3-10(4-2-9)18(15,16)8-7-17(12,13)14/h1-4H,5-8,11H2,(H2,12,13,14)/p-2