2-[(4-azanyl-3-ethoxy-phenyl)-ethyl-amino]ethanesulfonic acid

Systemtic Name: 2-[(4-azanyl-3-ethoxy-phenyl)-ethyl-amino]ethanesulfonic acid Openeye Name: 2-(4-amino-3-ethoxy-N-ethyl-anilino)ethanesulfonic acid CAS Name: 2-(4-amino-3-ethoxy-N-ethylanilino)ethanesulfonic acid IUPAC Name: 2-(4-amino-3-ethoxy-N-ethylanilino)ethanesulfonic acid Traditional Name: 2-(4-amino-3-ethoxy-N-ethyl-anilino)ethanesulfonic acid Formula: C12H20N2O4S MolecularWeight: 288.3632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCS(=O)(=O)O)C1=CC(=C(C=C1)N)OCC

Isomeric SMILES

CCN(CCS(=O)(=O)O)C1=CC(=C(C=C1)N)OCC

InChI

InChI=1S/C12H20N2O4S/c1-3-14(7-8-19(15,16)17)10-5-6-11(13)12(9-10)18-4-2/h5-6,9H,3-4,7-8,13H2,1-2H3,(H,15,16,17)