[2-(furan-2-yl)-6,8-dimethyl-4-oxidanylidene-chromen-3-yl] benzenesulfonate

Systemtic Name: [2-(furan-2-yl)-6,8-dimethyl-4-oxidanylidene-chromen-3-yl] benzenesulfonate Openeye Name: [2-(2-furyl)-6,8-dimethyl-4-oxo-chromen-3-yl] benzenesulfonate CAS Name: benzenesulfonic acid [2-(2-furanyl)-6,8-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(furan-2-yl)-6,8-dimethyl-4-oxochromen-3-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-(2-furyl)-4-keto-6,8-dimethyl-chromen-3-yl] ester Formula: C21H16O6S MolecularWeight: 396.41314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC=CO3)OS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC=CO3)OS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C21H16O6S/c1-13-11-14(2)19-16(12-13)18(22)21(20(26-19)17-9-6-10-25-17)27-28(23,24)15-7-4-3-5-8-15/h3-12H,1-2H3