4-(1-benzofuran-3-yl)butane-1-sulfonic acid

Systemtic Name: 4-(1-benzofuran-3-yl)butane-1-sulfonic acid Openeye Name: 4-(benzofuran-3-yl)butane-1-sulfonic acid CAS Name: 4-(3-benzofuranyl)-1-butanesulfonic acid IUPAC Name: 4-(1-benzofuran-3-yl)butane-1-sulfonic acid Traditional Name: 4-(benzofuran-3-yl)butane-1-sulfonic acid Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CO2)CCCCS(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CO2)CCCCS(=O)(=O)O

InChI

InChI=1S/C12H14O4S/c13-17(14,15)8-4-3-5-10-9-16-12-7-2-1-6-11(10)12/h1-2,6-7,9H,3-5,8H2,(H,13,14,15)