2-(8-chloranylnaphthalen-1-yl)-2-sulfanyl-ethanoic acid

Systemtic Name: 2-(8-chloranylnaphthalen-1-yl)-2-sulfanyl-ethanoic acid Openeye Name: 2-(8-chloro-1-naphthyl)-2-sulfanyl-acetic acid CAS Name: 2-(8-chloro-1-naphthalenyl)-2-mercaptoacetic acid IUPAC Name: 2-(8-chloronaphthalen-1-yl)-2-sulfanylacetic acid Traditional Name: 2-(8-chloro-1-naphthyl)-2-mercapto-acetic acid Formula: C12H9ClO2S MolecularWeight: 252.71666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(C(=O)O)S)C(=CC=C2)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)C(C(=O)O)S)C(=CC=C2)Cl

InChI

InChI=1S/C12H9ClO2S/c13-9-6-2-4-7-3-1-5-8(10(7)9)11(16)12(14)15/h1-6,11,16H,(H,14,15)