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

Systemtic Name: 2-[7-(4-chlorophenyl)carbonyl-6-oxidanyl-2,3-dihydro-1-benzofuran-5-yl]propanoic acid Openeye Name: 2-[7-(4-chlorobenzoyl)-6-hydroxy-2,3-dihydrobenzofuran-5-yl]propanoic acid CAS Name: 2-[7-[(4-chlorophenyl)-oxomethyl]-6-hydroxy-2,3-dihydrobenzofuran-5-yl]propanoic acid IUPAC Name: 2-[7-(4-chlorobenzoyl)-6-hydroxy-2,3-dihydro-1-benzofuran-5-yl]propanoic acid Traditional Name: 2-[7-(4-chlorobenzoyl)-6-hydroxy-coumaran-5-yl]propionic acid Formula: C18H15ClO5 MolecularWeight: 346.7617

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=C2C(=C1)CCO2)C(=O)C3=CC=C(C=C3)Cl)O)C(=O)O

Isomeric SMILES

CC(C1=C(C(=C2C(=C1)CCO2)C(=O)C3=CC=C(C=C3)Cl)O)C(=O)O

InChI

InChI=1S/C18H15ClO5/c1-9(18(22)23)13-8-11-6-7-24-17(11)14(16(13)21)15(20)10-2-4-12(19)5-3-10/h2-5,8-9,21H,6-7H2,1H3,(H,22,23)