3-(2-carboxyethylsulfonylamino)-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-(2-carboxyethylsulfonylamino)-3-thiophen-2-yl-propanoic acid Openeye Name: 3-(2-carboxyethylsulfonylamino)-3-(2-thienyl)propanoic acid CAS Name: 3-(2-carboxyethylsulfonylamino)-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-(2-carboxyethylsulfonylamino)-3-thiophen-2-ylpropanoic acid Traditional Name: 3-(2-carboxyethylsulfonylamino)-3-(2-thienyl)propionic acid Formula: C10H13NO6S2 MolecularWeight: 307.34332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(CC(=O)O)NS(=O)(=O)CCC(=O)O

Isomeric SMILES

C1=CSC(=C1)C(CC(=O)O)NS(=O)(=O)CCC(=O)O

InChI

InChI=1S/C10H13NO6S2/c12-9(13)3-5-19(16,17)11-7(6-10(14)15)8-2-1-4-18-8/h1-2,4,7,11H,3,5-6H2,(H,12,13)(H,14,15)