6,7-bis(chloranyl)-5-[(4-methoxyphenyl)-oxidanyl-methyl]-2,3-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: 6,7-bis(chloranyl)-5-[(4-methoxyphenyl)-oxidanyl-methyl]-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 6,7-dichloro-5-[hydroxy-(4-methoxyphenyl)methyl]-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 6,7-dichloro-5-[hydroxy-(4-methoxyphenyl)methyl]-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 6,7-dichloro-5-[hydroxy-(4-methoxyphenyl)methyl]-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 6,7-dichloro-5-[hydroxy-(4-methoxyphenyl)methyl]coumaran-2-carboxylic acid Formula: C17H14Cl2O5 MolecularWeight: 369.19606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=C(C(=C3C(=C2)CC(O3)C(=O)O)Cl)Cl)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=C(C(=C3C(=C2)CC(O3)C(=O)O)Cl)Cl)O

InChI

InChI=1S/C17H14Cl2O5/c1-23-10-4-2-8(3-5-10)15(20)11-6-9-7-12(17(21)22)24-16(9)14(19)13(11)18/h2-6,12,15,20H,7H2,1H3,(H,21,22)