2-acetamido-5,7,7-trimethyl-octanoic acid

Systemtic Name: 2-acetamido-5,7,7-trimethyl-octanoic acid Openeye Name: 2-acetamido-5,7,7-trimethyl-octanoic acid CAS Name: 2-acetamido-5,7,7-trimethyloctanoic acid IUPAC Name: 2-acetamido-5,7,7-trimethyloctanoic acid Traditional Name: 2-acetamido-5,7,7-trimethyl-caprylic acid Formula: C13H25NO3 MolecularWeight: 243.3425

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C(=O)O)NC(=O)C)CC(C)(C)C

Isomeric SMILES

CC(CCC(C(=O)O)NC(=O)C)CC(C)(C)C

InChI

InChI=1S/C13H25NO3/c1-9(8-13(3,4)5)6-7-11(12(16)17)14-10(2)15/h9,11H,6-8H2,1-5H3,(H,14,15)(H,16,17)