1-(2-acetamidoethyl)-4-methyl-2-oxidanyl-6-oxidanylidene-pyridine-3-sulfonic acid

Systemtic Name: 1-(2-acetamidoethyl)-4-methyl-2-oxidanyl-6-oxidanylidene-pyridine-3-sulfonic acid Openeye Name: 1-(2-acetamidoethyl)-2-hydroxy-4-methyl-6-oxo-pyridine-3-sulfonic acid CAS Name: 1-(2-acetamidoethyl)-2-hydroxy-4-methyl-6-oxo-3-pyridinesulfonic acid IUPAC Name: 1-(2-acetamidoethyl)-2-hydroxy-4-methyl-6-oxopyridine-3-sulfonic acid Traditional Name: 1-(2-acetamidoethyl)-2-hydroxy-6-keto-4-methyl-pyridine-3-sulfonic acid Formula: C10H14N2O6S MolecularWeight: 290.29296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=C1S(=O)(=O)O)O)CCNC(=O)C

Isomeric SMILES

CC1=CC(=O)N(C(=C1S(=O)(=O)O)O)CCNC(=O)C

InChI

InChI=1S/C10H14N2O6S/c1-6-5-8(14)12(4-3-11-7(2)13)10(15)9(6)19(16,17)18/h5,15H,3-4H2,1-2H3,(H,11,13)(H,16,17,18)