2-[7-(4-chlorophenyl)carbonyl-6-oxidanyl-2,3-dihydro-1-benzofuran-5-yl]ethanoic acid

Systemtic Name: 2-[7-(4-chlorophenyl)carbonyl-6-oxidanyl-2,3-dihydro-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[7-(4-chlorobenzoyl)-6-hydroxy-2,3-dihydrobenzofuran-5-yl]acetic acid CAS Name: 2-[7-[(4-chlorophenyl)-oxomethyl]-6-hydroxy-2,3-dihydrobenzofuran-5-yl]acetic acid IUPAC Name: 2-[7-(4-chlorobenzoyl)-6-hydroxy-2,3-dihydro-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[7-(4-chlorobenzoyl)-6-hydroxy-coumaran-5-yl]acetic acid Formula: C17H13ClO5 MolecularWeight: 332.73512

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=C(C=C21)CC(=O)O)O)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1COC2=C(C(=C(C=C21)CC(=O)O)O)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClO5/c18-12-3-1-9(2-4-12)15(21)14-16(22)11(8-13(19)20)7-10-5-6-23-17(10)14/h1-4,7,22H,5-6,8H2,(H,19,20)