3-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]propanoic acid

Systemtic Name: 3-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]propanoic acid Openeye Name: 3-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]propanoic acid CAS Name: 3-[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]propanoic acid Traditional Name: 3-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]propionic acid Formula: C13H16ClNO4 MolecularWeight: 285.72344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC(=O)NCCC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC(=O)NCCC(=O)O

InChI

InChI=1S/C13H16ClNO4/c1-8-5-10(6-9(2)13(8)14)19-7-11(16)15-4-3-12(17)18/h5-6H,3-4,7H2,1-2H3,(H,15,16)(H,17,18)