(4-ethanoyl-2-methoxy-phenyl) 2,3-dihydro-1,4-benzodioxine-6-sulfonate

Systemtic Name: (4-ethanoyl-2-methoxy-phenyl) 2,3-dihydro-1,4-benzodioxine-6-sulfonate Openeye Name: (4-acetyl-2-methoxy-phenyl) 2,3-dihydro-1,4-benzodioxine-6-sulfonate CAS Name: 2,3-dihydro-1,4-benzodioxin-6-sulfonic acid (4-acetyl-2-methoxyphenyl) ester IUPAC Name: (4-acetyl-2-methoxyphenyl) 2,3-dihydro-1,4-benzodioxine-6-sulfonate Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-sulfonic acid (4-acetyl-2-methoxy-phenyl) ester Formula: C17H16O7S MolecularWeight: 364.36974

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OS(=O)(=O)C2=CC3=C(C=C2)OCCO3)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OS(=O)(=O)C2=CC3=C(C=C2)OCCO3)OC

InChI

InChI=1S/C17H16O7S/c1-11(18)12-3-5-15(16(9-12)21-2)24-25(19,20)13-4-6-14-17(10-13)23-8-7-22-14/h3-6,9-10H,7-8H2,1-2H3