3-[2-(2-chloranyl-5-methyl-phenoxy)ethanoylamino]butanoic acid

Systemtic Name: 3-[2-(2-chloranyl-5-methyl-phenoxy)ethanoylamino]butanoic acid Openeye Name: 3-[[2-(2-chloro-5-methyl-phenoxy)acetyl]amino]butanoic acid CAS Name: 3-[[2-(2-chloro-5-methylphenoxy)-1-oxoethyl]amino]butanoic acid IUPAC Name: 3-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]butanoic acid Traditional Name: 3-[[2-(2-chloro-5-methyl-phenoxy)acetyl]amino]butyric acid Formula: C13H16ClNO4 MolecularWeight: 285.72344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNO4/c1-8-3-4-10(14)11(5-8)19-7-12(16)15-9(2)6-13(17)18/h3-5,9H,6-7H2,1-2H3,(H,15,16)(H,17,18)