3-(3-methylsulfonylpropanoylamino)butanoic acid

Systemtic Name: 3-(3-methylsulfonylpropanoylamino)butanoic acid Openeye Name: 3-(3-methylsulfonylpropanoylamino)butanoic acid CAS Name: 3-[(3-methylsulfonyl-1-oxopropyl)amino]butanoic acid IUPAC Name: 3-(3-methylsulfonylpropanoylamino)butanoic acid Traditional Name: 3-(3-mesylpropanoylamino)butyric acid Formula: C8H15NO5S MolecularWeight: 237.2734

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)CCS(=O)(=O)C

Isomeric SMILES

CC(CC(=O)O)NC(=O)CCS(=O)(=O)C

InChI

InChI=1S/C8H15NO5S/c1-6(5-8(11)12)9-7(10)3-4-15(2,13)14/h6H,3-5H2,1-2H3,(H,9,10)(H,11,12)