3-chloranyl-4-methanoyloxy-5-(oxiran-2-ylmethoxy)-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-chloranyl-4-methanoyloxy-5-(oxiran-2-ylmethoxy)-1-benzothiophene-2-carboxylic acid Openeye Name: 3-chloro-4-formyloxy-5-(oxiran-2-ylmethoxy)benzothiophene-2-carboxylic acid CAS Name: 3-chloro-4-formyloxy-5-(2-oxiranylmethoxy)-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-chloro-4-formyloxy-5-(oxiran-2-ylmethoxy)-1-benzothiophene-2-carboxylic acid Traditional Name: 3-chloro-4-formyloxy-5-glycidoxy-benzothiophene-2-carboxylic acid Formula: C13H9ClO6S MolecularWeight: 328.72496

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)COC2=C(C3=C(C=C2)SC(=C3Cl)C(=O)O)OC=O

Isomeric SMILES

C1C(O1)COC2=C(C3=C(C=C2)SC(=C3Cl)C(=O)O)OC=O

InChI

InChI=1S/C13H9ClO6S/c14-10-9-8(21-12(10)13(16)17)2-1-7(11(9)20-5-15)19-4-6-3-18-6/h1-2,5-6H,3-4H2,(H,16,17)