3-[4-butanoyl-2,3-bis(chloranyl)phenoxy]propanoic acid

Systemtic Name: 3-[4-butanoyl-2,3-bis(chloranyl)phenoxy]propanoic acid Openeye Name: 3-(4-butanoyl-2,3-dichloro-phenoxy)propanoic acid CAS Name: 3-[2,3-dichloro-4-(1-oxobutyl)phenoxy]propanoic acid IUPAC Name: 3-(4-butanoyl-2,3-dichlorophenoxy)propanoic acid Traditional Name: 3-(4-butyryl-2,3-dichloro-phenoxy)propionic acid Formula: C13H14Cl2O4 MolecularWeight: 305.15386

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C(=C(C=C1)OCCC(=O)O)Cl)Cl

Isomeric SMILES

CCCC(=O)C1=C(C(=C(C=C1)OCCC(=O)O)Cl)Cl

InChI

InChI=1S/C13H14Cl2O4/c1-2-3-9(16)8-4-5-10(13(15)12(8)14)19-7-6-11(17)18/h4-5H,2-3,6-7H2,1H3,(H,17,18)