5-[2,5-bis(chloranyl)phenyl]sulfanylpentanoic acid

Systemtic Name: 5-[2,5-bis(chloranyl)phenyl]sulfanylpentanoic acid Openeye Name: 5-(2,5-dichlorophenyl)sulfanylpentanoic acid CAS Name: 5-[(2,5-dichlorophenyl)thio]pentanoic acid IUPAC Name: 5-(2,5-dichlorophenyl)sulfanylpentanoic acid Traditional Name: 5-[(2,5-dichlorophenyl)thio]valeric acid Formula: C11H12Cl2O2S MolecularWeight: 279.18278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)SCCCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1Cl)SCCCCC(=O)O)Cl

InChI

InChI=1S/C11H12Cl2O2S/c12-8-4-5-9(13)10(7-8)16-6-2-1-3-11(14)15/h4-5,7H,1-3,6H2,(H,14,15)