6-chloranyl-5-[oxidanyl(thiophen-2-yl)methyl]-2,3-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: 6-chloranyl-5-[oxidanyl(thiophen-2-yl)methyl]-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 6-chloro-5-[hydroxy(2-thienyl)methyl]-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 6-chloro-5-[hydroxy(thiophen-2-yl)methyl]-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 6-chloro-5-[hydroxy(thiophen-2-yl)methyl]-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 6-chloro-5-[hydroxy(2-thienyl)methyl]coumaran-2-carboxylic acid Formula: C14H11ClO4S MolecularWeight: 310.75274

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC(=C(C=C21)C(C3=CC=CS3)O)Cl)C(=O)O

Isomeric SMILES

C1C(OC2=CC(=C(C=C21)C(C3=CC=CS3)O)Cl)C(=O)O

InChI

InChI=1S/C14H11ClO4S/c15-9-6-10-7(5-11(19-10)14(17)18)4-8(9)13(16)12-2-1-3-20-12/h1-4,6,11,13,16H,5H2,(H,17,18)