1-[(4-azanyl-3-ethoxy-phenyl)-ethyl-amino]ethanesulfonic acid

Systemtic Name: 1-[(4-azanyl-3-ethoxy-phenyl)-ethyl-amino]ethanesulfonic acid Openeye Name: 1-(4-amino-3-ethoxy-N-ethyl-anilino)ethanesulfonic acid CAS Name: 1-(4-amino-3-ethoxy-N-ethylanilino)ethanesulfonic acid IUPAC Name: 1-(4-amino-3-ethoxy-N-ethylanilino)ethanesulfonic acid Traditional Name: 1-(4-amino-3-ethoxy-N-ethyl-anilino)ethanesulfonic acid Formula: C12H20N2O4S MolecularWeight: 288.3632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2O4S/c1-4-14(9(3)19(15,16)17)10-6-7-11(13)12(8-10)18-5-2/h6-9H,4-5,13H2,1-3H3,(H,15,16,17)