2-[2-(5-chloranylthiophen-2-yl)ethyl]benzoic acid

Systemtic Name: 2-[2-(5-chloranylthiophen-2-yl)ethyl]benzoic acid Openeye Name: 2-[2-(5-chloro-2-thienyl)ethyl]benzoic acid CAS Name: 2-[2-(5-chloro-2-thiophenyl)ethyl]benzoic acid IUPAC Name: 2-[2-(5-chlorothiophen-2-yl)ethyl]benzoic acid Traditional Name: 2-[2-(5-chloro-2-thienyl)ethyl]benzoic acid Formula: C13H11ClO2S MolecularWeight: 266.74324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCC2=CC=C(S2)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CCC2=CC=C(S2)Cl)C(=O)O

InChI

InChI=1S/C13H11ClO2S/c14-12-8-7-10(17-12)6-5-9-3-1-2-4-11(9)13(15)16/h1-4,7-8H,5-6H2,(H,15,16)