4-[3-(2,6-dimethylphenoxy)propanoylamino]butanoic acid

Systemtic Name: 4-[3-(2,6-dimethylphenoxy)propanoylamino]butanoic acid Openeye Name: 4-[3-(2,6-dimethylphenoxy)propanoylamino]butanoic acid CAS Name: 4-[[3-(2,6-dimethylphenoxy)-1-oxopropyl]amino]butanoic acid IUPAC Name: 4-[3-(2,6-dimethylphenoxy)propanoylamino]butanoic acid Traditional Name: 4-[3-(2,6-dimethylphenoxy)propanoylamino]butyric acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO4/c1-11-5-3-6-12(2)15(11)20-10-8-13(17)16-9-4-7-14(18)19/h3,5-6H,4,7-10H2,1-2H3,(H,16,17)(H,18,19)