3-[(2-ethoxy-2-oxidanylidene-1-phenyl-ethyl)amino]propane-1-sulfonic acid

Systemtic Name: 3-[(2-ethoxy-2-oxidanylidene-1-phenyl-ethyl)amino]propane-1-sulfonic acid Openeye Name: 3-[(2-ethoxy-2-oxo-1-phenyl-ethyl)amino]propane-1-sulfonic acid CAS Name: 3-[(2-ethoxy-2-oxo-1-phenylethyl)amino]-1-propanesulfonic acid IUPAC Name: 3-[(2-ethoxy-2-oxo-1-phenylethyl)amino]propane-1-sulfonic acid Traditional Name: 3-[(2-ethoxy-2-keto-1-phenyl-ethyl)amino]propane-1-sulfonic acid Formula: C13H19NO5S MolecularWeight: 301.35866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)NCCCS(=O)(=O)O

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)NCCCS(=O)(=O)O

InChI

InChI=1S/C13H19NO5S/c1-2-19-13(15)12(11-7-4-3-5-8-11)14-9-6-10-20(16,17)18/h3-5,7-8,12,14H,2,6,9-10H2,1H3,(H,16,17,18)