sodium 5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-2-sulfonate

Systemtic Name: sodium 5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-2-sulfonate Openeye Name: sodium 5-(2,3-dihydrobenzofuran-5-yl)thiophene-2-sulfonate CAS Name: sodium 5-(2,3-dihydrobenzofuran-5-yl)-2-thiophenesulfonate IUPAC Name: sodium 5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-2-sulfonate Traditional Name: sodium 5-coumaran-5-ylthiophene-2-sulfonate Formula: C12H9NaO4S2 MolecularWeight: 304.31723

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C3=CC=C(S3)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1COC2=C1C=C(C=C2)C3=CC=C(S3)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C12H10O4S2.Na/c13-18(14,15)12-4-3-11(17-12)9-1-2-10-8(7-9)5-6-16-10;/h1-4,7H,5-6H2,(H,13,14,15);/q;+1/p-1