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

Systemtic Name: 5-butanoyl-6,7-bis(chloranyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 5-butanoyl-6,7-dichloro-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 6,7-dichloro-5-(1-oxobutyl)-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 5-butanoyl-6,7-dichloro-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 5-butyryl-6,7-dichloro-coumaran-2-carboxylic acid Formula: C13H12Cl2O4 MolecularWeight: 303.13798

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C(=C1Cl)Cl)OC(C2)C(=O)O

Isomeric SMILES

CCCC(=O)C1=CC2=C(C(=C1Cl)Cl)OC(C2)C(=O)O

InChI

InChI=1S/C13H12Cl2O4/c1-2-3-8(16)7-4-6-5-9(13(17)18)19-12(6)11(15)10(7)14/h4,9H,2-3,5H2,1H3,(H,17,18)