6,7-bis(chloranyl)-5-thiophen-3-ylsulfonyl-2,3-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: 6,7-bis(chloranyl)-5-thiophen-3-ylsulfonyl-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 6,7-dichloro-5-(3-thienylsulfonyl)-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 6,7-dichloro-5-(3-thiophenylsulfonyl)-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 6,7-dichloro-5-thiophen-3-ylsulfonyl-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 6,7-dichloro-5-(3-thienylsulfonyl)coumaran-2-carboxylic acid Formula: C13H8Cl2O5S2 MolecularWeight: 379.23562

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(C(=C(C=C21)S(=O)(=O)C3=CSC=C3)Cl)Cl)C(=O)O

Isomeric SMILES

C1C(OC2=C(C(=C(C=C21)S(=O)(=O)C3=CSC=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C13H8Cl2O5S2/c14-10-9(22(18,19)7-1-2-21-5-7)4-6-3-8(13(16)17)20-12(6)11(10)15/h1-2,4-5,8H,3H2,(H,16,17)