2-methoxy-5-[(4-oxidanyl-4-oxidanylidene-butyl)sulfamoyl]benzoic acid

Systemtic Name: 2-methoxy-5-[(4-oxidanyl-4-oxidanylidene-butyl)sulfamoyl]benzoic acid Openeye Name: 5-[(4-hydroxy-4-oxo-butyl)sulfamoyl]-2-methoxy-benzoic acid CAS Name: 5-[(4-hydroxy-4-oxobutyl)sulfamoyl]-2-methoxybenzoic acid IUPAC Name: 5-[(4-hydroxy-4-oxobutyl)sulfamoyl]-2-methoxybenzoic acid Traditional Name: 5-[(4-hydroxy-4-keto-butyl)sulfamoyl]-2-methoxy-benzoic acid Formula: C12H15NO7S MolecularWeight: 317.315

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)O)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)O)C(=O)O

InChI

InChI=1S/C12H15NO7S/c1-20-10-5-4-8(7-9(10)12(16)17)21(18,19)13-6-2-3-11(14)15/h4-5,7,13H,2-3,6H2,1H3,(H,14,15)(H,16,17)