2-(hexanoylamino)-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-(hexanoylamino)-4-methylsulfonyl-butanoic acid Openeye Name: 2-(hexanoylamino)-4-methylsulfonyl-butanoic acid CAS Name: 4-methylsulfonyl-2-(1-oxohexylamino)butanoic acid IUPAC Name: 2-(hexanoylamino)-4-methylsulfonylbutanoic acid Traditional Name: 2-(caproylamino)-4-mesyl-butyric acid Formula: C11H21NO5S MolecularWeight: 279.35314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(CCS(=O)(=O)C)C(=O)O

Isomeric SMILES

CCCCCC(=O)NC(CCS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C11H21NO5S/c1-3-4-5-6-10(13)12-9(11(14)15)7-8-18(2,16)17/h9H,3-8H2,1-2H3,(H,12,13)(H,14,15)