3-[2,5-bis(chloranyl)thiophen-3-yl]-5-methoxycarbonyl-benzoic acid

Systemtic Name: 3-[2,5-bis(chloranyl)thiophen-3-yl]-5-methoxycarbonyl-benzoic acid Openeye Name: 3-(2,5-dichloro-3-thienyl)-5-methoxycarbonyl-benzoic acid CAS Name: 3-(2,5-dichloro-3-thiophenyl)-5-methoxycarbonylbenzoic acid IUPAC Name: 3-(2,5-dichlorothiophen-3-yl)-5-methoxycarbonylbenzoic acid Traditional Name: 3-carbomethoxy-5-(2,5-dichloro-3-thienyl)benzoic acid Formula: C13H8Cl2O4S MolecularWeight: 331.17122

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)O)C2=C(SC(=C2)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)O)C2=C(SC(=C2)Cl)Cl

InChI

InChI=1S/C13H8Cl2O4S/c1-19-13(18)8-3-6(2-7(4-8)12(16)17)9-5-10(14)20-11(9)15/h2-5H,1H3,(H,16,17)