3-methyl-2-[2-(2,3,6-trimethylphenoxy)ethanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-(2,3,6-trimethylphenoxy)ethanoylamino]butanoic acid Openeye Name: 3-methyl-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]butanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-(2,3,6-trimethylphenoxy)ethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]butanoic acid Traditional Name: 3-methyl-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]butyric acid Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC(=O)NC(C(C)C)C(=O)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCC(=O)NC(C(C)C)C(=O)O)C

InChI

InChI=1S/C16H23NO4/c1-9(2)14(16(19)20)17-13(18)8-21-15-11(4)7-6-10(3)12(15)5/h6-7,9,14H,8H2,1-5H3,(H,17,18)(H,19,20)