(2,2-dimethyl-8-oxidanylidene-10-propyl-pyrano[2,3-f]chromen-5-yl) 4-methylbenzenesulfonate

Systemtic Name: (2,2-dimethyl-8-oxidanylidene-10-propyl-pyrano[2,3-f]chromen-5-yl) 4-methylbenzenesulfonate Openeye Name: (2,2-dimethyl-8-oxo-10-propyl-pyrano[2,3-f]chromen-5-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2,2-dimethyl-8-oxo-10-propyl-5-pyrano[2,3-f][1]benzopyranyl) ester IUPAC Name: (2,2-dimethyl-8-oxo-10-propylpyrano[2,3-f]chromen-5-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (8-keto-2,2-dimethyl-10-propyl-pyrano[2,3-f]chromen-5-yl) ester Formula: C24H24O6S MolecularWeight: 440.50876

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=CC(=C3C=CC(OC3=C12)(C)C)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCC1=CC(=O)OC2=CC(=C3C=CC(OC3=C12)(C)C)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H24O6S/c1-5-6-16-13-21(25)28-20-14-19(18-11-12-24(3,4)29-23(18)22(16)20)30-31(26,27)17-9-7-15(2)8-10-17/h7-14H,5-6H2,1-4H3