3-[2-(5-chloranyl-2-methoxy-phenyl)ethanoylamino]butanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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