5-(sulfomethyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: 5-(sulfomethyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 5-(sulfomethyl)-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 5-(sulfomethyl)-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 5-(sulfomethyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 5-(sulfomethyl)coumaran-2-carboxylic acid Formula: C10H10O6S MolecularWeight: 258.2478

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)CS(=O)(=O)O)C(=O)O

Isomeric SMILES

C1C(OC2=C1C=C(C=C2)CS(=O)(=O)O)C(=O)O

InChI

InChI=1S/C10H10O6S/c11-10(12)9-4-7-3-6(5-17(13,14)15)1-2-8(7)16-9/h1-3,9H,4-5H2,(H,11,12)(H,13,14,15)