4-(3-methylsulfonylpropanoylamino)butanoic acid

Systemtic Name: 4-(3-methylsulfonylpropanoylamino)butanoic acid Openeye Name: 4-(3-methylsulfonylpropanoylamino)butanoic acid CAS Name: 4-[(3-methylsulfonyl-1-oxopropyl)amino]butanoic acid IUPAC Name: 4-(3-methylsulfonylpropanoylamino)butanoic acid Traditional Name: 4-(3-mesylpropanoylamino)butyric acid Formula: C8H15NO5S MolecularWeight: 237.2734

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(=O)NCCCC(=O)O

Isomeric SMILES

CS(=O)(=O)CCC(=O)NCCCC(=O)O

InChI

InChI=1S/C8H15NO5S/c1-15(13,14)6-4-7(10)9-5-2-3-8(11)12/h2-6H2,1H3,(H,9,10)(H,11,12)