(2S)-3-[(3,4-dimethylphenyl)sulfamoyl]-2-methyl-propanoate

Systemtic Name: (2S)-3-[(3,4-dimethylphenyl)sulfamoyl]-2-methyl-propanoate Openeye Name: (2S)-3-[(3,4-dimethylphenyl)sulfamoyl]-2-methyl-propanoate CAS Name: (2S)-3-[(3,4-dimethylphenyl)sulfamoyl]-2-methylpropanoate IUPAC Name: (2S)-3-[(3,4-dimethylphenyl)sulfamoyl]-2-methylpropanoate Traditional Name: (2S)-3-[(3,4-dimethylphenyl)sulfamoyl]-2-methyl-propionate Formula: C12H16NO4S- MolecularWeight: 270.32474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)CC(C)C(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C[C@@H](C)C(=O)[O-])C

InChI

InChI=1S/C12H17NO4S/c1-8-4-5-11(6-9(8)2)13-18(16,17)7-10(3)12(14)15/h4-6,10,13H,7H2,1-3H3,(H,14,15)/p-1/t10-/m1/s1