3-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]butanoic acid

Systemtic Name: 3-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]butanoic acid Openeye Name: 3-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]butanoic acid CAS Name: 3-[[2-(4-chloro-2-methylphenoxy)-1-oxopropyl]amino]butanoic acid IUPAC Name: 3-[2-(4-chloro-2-methylphenoxy)propanoylamino]butanoic acid Traditional Name: 3-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]butyric acid Formula: C14H18ClNO4 MolecularWeight: 299.75002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18ClNO4/c1-8-6-11(15)4-5-12(8)20-10(3)14(19)16-9(2)7-13(17)18/h4-6,9-10H,7H2,1-3H3,(H,16,19)(H,17,18)