5-(4-chlorophenyl)-2-sulfanyl-pentanoic acid

Systemtic Name: 5-(4-chlorophenyl)-2-sulfanyl-pentanoic acid Openeye Name: 5-(4-chlorophenyl)-2-sulfanyl-pentanoic acid CAS Name: 5-(4-chlorophenyl)-2-mercaptopentanoic acid IUPAC Name: 5-(4-chlorophenyl)-2-sulfanylpentanoic acid Traditional Name: 5-(4-chlorophenyl)-2-mercapto-valeric acid Formula: C11H13ClO2S MolecularWeight: 244.73772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC(C(=O)O)S)Cl

Isomeric SMILES

C1=CC(=CC=C1CCCC(C(=O)O)S)Cl

InChI

InChI=1S/C11H13ClO2S/c12-9-6-4-8(5-7-9)2-1-3-10(15)11(13)14/h4-7,10,15H,1-3H2,(H,13,14)