5-[2,3-bis(chloranyl)-4-methanoyl-phenoxy]pentanoic acid

Systemtic Name: 5-[2,3-bis(chloranyl)-4-methanoyl-phenoxy]pentanoic acid Openeye Name: 5-(2,3-dichloro-4-formyl-phenoxy)pentanoic acid CAS Name: 5-(2,3-dichloro-4-formylphenoxy)pentanoic acid IUPAC Name: 5-(2,3-dichloro-4-formylphenoxy)pentanoic acid Traditional Name: 5-(2,3-dichloro-4-formyl-phenoxy)valeric acid Formula: C12H12Cl2O4 MolecularWeight: 291.12728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1C=O)Cl)Cl)OCCCCC(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1C=O)Cl)Cl)OCCCCC(=O)O

InChI

InChI=1S/C12H12Cl2O4/c13-11-8(7-15)4-5-9(12(11)14)18-6-2-1-3-10(16)17/h4-5,7H,1-3,6H2,(H,16,17)