(2-chloranyl-3,3-dimethyl-2H-1-benzofuran-5-yl)methanesulfonic acid

Systemtic Name: (2-chloranyl-3,3-dimethyl-2H-1-benzofuran-5-yl)methanesulfonic acid Openeye Name: (2-chloro-3,3-dimethyl-2H-benzofuran-5-yl)methanesulfonic acid CAS Name: (2-chloro-3,3-dimethyl-2H-benzofuran-5-yl)methanesulfonic acid IUPAC Name: (2-chloro-3,3-dimethyl-2H-1-benzofuran-5-yl)methanesulfonic acid Traditional Name: (2-chloro-3,3-dimethyl-coumaran-5-yl)methanesulfonic acid Formula: C11H13ClO4S MolecularWeight: 276.73652

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC2=C1C=C(C=C2)CS(=O)(=O)O)Cl)C

Isomeric SMILES

CC1(C(OC2=C1C=C(C=C2)CS(=O)(=O)O)Cl)C

InChI

InChI=1S/C11H13ClO4S/c1-11(2)8-5-7(6-17(13,14)15)3-4-9(8)16-10(11)12/h3-5,10H,6H2,1-2H3,(H,13,14,15)