[1-(2-acetamidoethyl)-4-methyl-2-oxidanyl-6-oxidanylidene-pyridin-3-yl]methanesulfonic acid

Systemtic Name: [1-(2-acetamidoethyl)-4-methyl-2-oxidanyl-6-oxidanylidene-pyridin-3-yl]methanesulfonic acid Openeye Name: [1-(2-acetamidoethyl)-2-hydroxy-4-methyl-6-oxo-3-pyridyl]methanesulfonic acid CAS Name: [1-(2-acetamidoethyl)-2-hydroxy-4-methyl-6-oxo-3-pyridinyl]methanesulfonic acid IUPAC Name: [1-(2-acetamidoethyl)-2-hydroxy-4-methyl-6-oxopyridin-3-yl]methanesulfonic acid Traditional Name: [1-(2-acetamidoethyl)-2-hydroxy-6-keto-4-methyl-3-pyridyl]methanesulfonic acid Formula: C11H16N2O6S MolecularWeight: 304.31954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=C1CS(=O)(=O)O)O)CCNC(=O)C

Isomeric SMILES

CC1=CC(=O)N(C(=C1CS(=O)(=O)O)O)CCNC(=O)C

InChI

InChI=1S/C11H16N2O6S/c1-7-5-10(15)13(4-3-12-8(2)14)11(16)9(7)6-20(17,18)19/h5,16H,3-4,6H2,1-2H3,(H,12,14)(H,17,18,19)