(2,2-dimethyl-3H-1-benzofuran-7-yl) 3-acetamido-4-methoxy-benzenesulfonate

Systemtic Name: (2,2-dimethyl-3H-1-benzofuran-7-yl) 3-acetamido-4-methoxy-benzenesulfonate Openeye Name: (2,2-dimethyl-3H-benzofuran-7-yl) 3-acetamido-4-methoxy-benzenesulfonate CAS Name: 3-acetamido-4-methoxybenzenesulfonic acid (2,2-dimethyl-3H-benzofuran-7-yl) ester IUPAC Name: (2,2-dimethyl-3H-1-benzofuran-7-yl) 3-acetamido-4-methoxybenzenesulfonate Traditional Name: 3-acetamido-4-methoxy-benzenesulfonic acid (2,2-dimethylcoumaran-7-yl) ester Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)OC2=CC=CC3=C2OC(C3)(C)C)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)OC2=CC=CC3=C2OC(C3)(C)C)OC

InChI

InChI=1S/C19H21NO6S/c1-12(21)20-15-10-14(8-9-16(15)24-4)27(22,23)26-17-7-5-6-13-11-19(2,3)25-18(13)17/h5-10H,11H2,1-4H3,(H,20,21)