(2-ethoxycarbonylpyridin-4-yl)methanesulfonic acid

Systemtic Name: (2-ethoxycarbonylpyridin-4-yl)methanesulfonic acid Openeye Name: (2-ethoxycarbonyl-4-pyridyl)methanesulfonic acid CAS Name: (2-ethoxycarbonyl-4-pyridinyl)methanesulfonic acid IUPAC Name: (2-ethoxycarbonylpyridin-4-yl)methanesulfonic acid Traditional Name: (2-carbethoxy-4-pyridyl)methanesulfonic acid Formula: C9H11NO5S MolecularWeight: 245.25234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC=CC(=C1)CS(=O)(=O)O

Isomeric SMILES

CCOC(=O)C1=NC=CC(=C1)CS(=O)(=O)O

InChI

InChI=1S/C9H11NO5S/c1-2-15-9(11)8-5-7(3-4-10-8)6-16(12,13)14/h3-5H,2,6H2,1H3,(H,12,13,14)