4-methylsulfonyl-2-(nonanoylamino)butanoic acid

Systemtic Name: 4-methylsulfonyl-2-(nonanoylamino)butanoic acid Openeye Name: 4-methylsulfonyl-2-(nonanoylamino)butanoic acid CAS Name: 4-methylsulfonyl-2-(1-oxononylamino)butanoic acid IUPAC Name: 4-methylsulfonyl-2-(nonanoylamino)butanoic acid Traditional Name: 4-mesyl-2-(pelargonylamino)butyric acid Formula: C14H27NO5S MolecularWeight: 321.43288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NC(CCS(=O)(=O)C)C(=O)O

Isomeric SMILES

CCCCCCCCC(=O)NC(CCS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C14H27NO5S/c1-3-4-5-6-7-8-9-13(16)15-12(14(17)18)10-11-21(2,19)20/h12H,3-11H2,1-2H3,(H,15,16)(H,17,18)