2-[(2,5-dimethoxyphenyl)sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[(2,5-dimethoxyphenyl)sulfonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(2,5-dimethoxyphenyl)sulfonylamino]-3-methyl-butanoic acid CAS Name: 2-[(2,5-dimethoxyphenyl)sulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-[(2,5-dimethoxyphenyl)sulfonylamino]-3-methylbutanoic acid Traditional Name: 2-[(2,5-dimethoxyphenyl)sulfonylamino]-3-methyl-butyric acid Formula: C13H19NO6S MolecularWeight: 317.35806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)OC)OC

Isomeric SMILES

CC(C)C(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)OC)OC

InChI

InChI=1S/C13H19NO6S/c1-8(2)12(13(15)16)14-21(17,18)11-7-9(19-3)5-6-10(11)20-4/h5-8,12,14H,1-4H3,(H,15,16)