2-[[2-(acetyloxymethyl)-3-ethanoylsulfanyl-propanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[2-(acetyloxymethyl)-3-ethanoylsulfanyl-propanoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-(acetoxymethyl)-3-acetylsulfanyl-propanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-(acetyloxymethyl)-3-(acetylthio)-1-oxopropyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-(acetyloxymethyl)-3-acetylsulfanylpropanoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-(acetoxymethyl)-3-(acetylthio)propanoyl]amino]-4-methyl-valeric acid Formula: C14H23NO6S MolecularWeight: 333.40052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(COC(=O)C)CSC(=O)C

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(COC(=O)C)CSC(=O)C

InChI

InChI=1S/C14H23NO6S/c1-8(2)5-12(14(19)20)15-13(18)11(6-21-9(3)16)7-22-10(4)17/h8,11-12H,5-7H2,1-4H3,(H,15,18)(H,19,20)