4-[2-(2,4,6-trimethylphenoxy)ethanoylamino]butanoic acid

Systemtic Name: 4-[2-(2,4,6-trimethylphenoxy)ethanoylamino]butanoic acid Openeye Name: 4-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]butanoic acid CAS Name: 4-[[1-oxo-2-(2,4,6-trimethylphenoxy)ethyl]amino]butanoic acid IUPAC Name: 4-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]butanoic acid Traditional Name: 4-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]butyric acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(=O)NCCCC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC(=O)NCCCC(=O)O)C

InChI

InChI=1S/C15H21NO4/c1-10-7-11(2)15(12(3)8-10)20-9-13(17)16-6-4-5-14(18)19/h7-8H,4-6,9H2,1-3H3,(H,16,17)(H,18,19)