4-[3-(2-chloranylphenoxy)propanoylamino]butanoic acid

Systemtic Name: 4-[3-(2-chloranylphenoxy)propanoylamino]butanoic acid Openeye Name: 4-[3-(2-chlorophenoxy)propanoylamino]butanoic acid CAS Name: 4-[[3-(2-chlorophenoxy)-1-oxopropyl]amino]butanoic acid IUPAC Name: 4-[3-(2-chlorophenoxy)propanoylamino]butanoic acid Traditional Name: 4-[3-(2-chlorophenoxy)propanoylamino]butyric acid Formula: C13H16ClNO4 MolecularWeight: 285.72344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNO4/c14-10-4-1-2-5-11(10)19-9-7-12(16)15-8-3-6-13(17)18/h1-2,4-5H,3,6-9H2,(H,15,16)(H,17,18)