2-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]ethanesulfonic acid

Systemtic Name: 2-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]ethanesulfonic acid Openeye Name: 2-[[(E)-3-ethoxy-1-methyl-3-oxo-prop-1-enyl]amino]ethanesulfonic acid CAS Name: 2-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]ethanesulfonic acid IUPAC Name: 2-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]ethanesulfonic acid Traditional Name: 2-[[(E)-3-ethoxy-3-keto-1-methyl-prop-1-enyl]amino]ethanesulfonic acid Formula: C8H15NO5S MolecularWeight: 237.2734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NCCS(=O)(=O)O

Isomeric SMILES

CCOC(=O)/C=C(\C)/NCCS(=O)(=O)O

InChI

InChI=1S/C8H15NO5S/c1-3-14-8(10)6-7(2)9-4-5-15(11,12)13/h6,9H,3-5H2,1-2H3,(H,11,12,13)/b7-6+