(4,9-dimethoxy-7-oxidanylidene-furo[3,2-g]chromen-5-yl) 4-acetamidobenzenesulfonate

Systemtic Name: (4,9-dimethoxy-7-oxidanylidene-furo[3,2-g]chromen-5-yl) 4-acetamidobenzenesulfonate Openeye Name: (4,9-dimethoxy-7-oxo-furo[3,2-g]chromen-5-yl) 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid (4,9-dimethoxy-7-oxo-5-furo[3,2-g][1]benzopyranyl) ester IUPAC Name: (4,9-dimethoxy-7-oxofuro[3,2-g]chromen-5-yl) 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid (7-keto-4,9-dimethoxy-furo[3,2-g]chromen-5-yl) ester Formula: C21H17NO9S MolecularWeight: 459.42598

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)OC3=C(C4=C(C=CO4)C(=C23)OC)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)OC3=C(C4=C(C=CO4)C(=C23)OC)OC

InChI

InChI=1S/C21H17NO9S/c1-11(23)22-12-4-6-13(7-5-12)32(25,26)31-15-10-16(24)30-20-17(15)18(27-2)14-8-9-29-19(14)21(20)28-3/h4-10H,1-3H3,(H,22,23)