4-[5-(hydroxymethyl)thiophen-2-yl]oxane-4-carboxylic acid

Systemtic Name: 4-[5-(hydroxymethyl)thiophen-2-yl]oxane-4-carboxylic acid Openeye Name: 4-[5-(hydroxymethyl)-2-thienyl]tetrahydropyran-4-carboxylic acid CAS Name: 4-[5-(hydroxymethyl)-2-thiophenyl]-4-oxanecarboxylic acid IUPAC Name: 4-[5-(hydroxymethyl)thiophen-2-yl]oxane-4-carboxylic acid Traditional Name: 4-(5-methylol-2-thienyl)tetrahydropyran-4-carboxylic acid Formula: C11H14O4S MolecularWeight: 242.29146

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C2=CC=C(S2)CO)C(=O)O

Isomeric SMILES

C1COCCC1(C2=CC=C(S2)CO)C(=O)O

InChI

InChI=1S/C11H14O4S/c12-7-8-1-2-9(16-8)11(10(13)14)3-5-15-6-4-11/h1-2,12H,3-7H2,(H,13,14)