6-(methylsulfonylaminomethyl)-3,4-dihydro-2H-chromene-4-carboxylic acid

Systemtic Name: 6-(methylsulfonylaminomethyl)-3,4-dihydro-2H-chromene-4-carboxylic acid Openeye Name: 6-(methanesulfonamidomethyl)chromane-4-carboxylic acid CAS Name: 6-(methanesulfonamidomethyl)-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid IUPAC Name: 6-(methanesulfonamidomethyl)-3,4-dihydro-2H-chromene-4-carboxylic acid Traditional Name: 6-(methanesulfonamidomethyl)chroman-4-carboxylic acid Formula: C12H15NO5S MolecularWeight: 285.3162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1=CC2=C(C=C1)OCCC2C(=O)O

Isomeric SMILES

CS(=O)(=O)NCC1=CC2=C(C=C1)OCCC2C(=O)O

InChI

InChI=1S/C12H15NO5S/c1-19(16,17)13-7-8-2-3-11-10(6-8)9(12(14)15)4-5-18-11/h2-3,6,9,13H,4-5,7H2,1H3,(H,14,15)