(2S)-3-acetyloxy-2-(6-methylheptanoylamino)propanoic acid

Systemtic Name: (2S)-3-acetyloxy-2-(6-methylheptanoylamino)propanoic acid Openeye Name: (2S)-3-acetoxy-2-(6-methylheptanoylamino)propanoic acid CAS Name: (2S)-3-acetyloxy-2-[(6-methyl-1-oxoheptyl)amino]propanoic acid IUPAC Name: (2S)-3-acetyloxy-2-(6-methylheptanoylamino)propanoic acid Traditional Name: (2S)-3-acetoxy-2-(6-methylheptanoylamino)propionic acid Formula: C13H23NO5 MolecularWeight: 273.32542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)CCCCC(=O)N[C@@H](COC(=O)C)C(=O)O

InChI

InChI=1S/C13H23NO5/c1-9(2)6-4-5-7-12(16)14-11(13(17)18)8-19-10(3)15/h9,11H,4-8H2,1-3H3,(H,14,16)(H,17,18)/t11-/m0/s1