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5-methoxy-3-methoxycarbonyl-2-methyl-1-benzofuran-6-sulfonic acid

5-methoxy-3-methoxycarbonyl-2-methyl-1-benzofuran-6-sulfonic acid

Systemtic Name:5-methoxy-3-methoxycarbonyl-2-methyl-1-benzofuran-6-sulfonic acid
Openeye Name:5-methoxy-3-methoxycarbonyl-2-methyl-benzofuran-6-sulfonic acid
CAS Name:5-methoxy-3-methoxycarbonyl-2-methyl-6-benzofuransulfonic acid
IUPAC Name:5-methoxy-3-methoxycarbonyl-2-methyl-1-benzofuran-6-sulfonic acid
Traditional Name:3-carbomethoxy-5-methoxy-2-methyl-benzofuran-6-sulfonic acid
Formula: C12H12O7S
MolecularWeight: 300.28448
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2O1)S(=O)(=O)O)OC)C(=O)OC


Isomeric SMILES

CC1=C(C2=CC(=C(C=C2O1)S(=O)(=O)O)OC)C(=O)OC


InChI

InChI=1S/C12H12O7S/c1-6-11(12(13)18-3)7-4-9(17-2)10(20(14,15)16)5-8(7)19-6/h4-5H,1-3H3,(H,14,15,16)


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