[3-(3,4-dimethoxyphenyl)-2-oxidanylidene-chromen-7-yl] 4-methylbenzenesulfonate

Systemtic Name: [3-(3,4-dimethoxyphenyl)-2-oxidanylidene-chromen-7-yl] 4-methylbenzenesulfonate Openeye Name: [3-(3,4-dimethoxyphenyl)-2-oxo-chromen-7-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(3,4-dimethoxyphenyl)-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(3,4-dimethoxyphenyl)-2-oxochromen-7-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-(3,4-dimethoxyphenyl)-2-keto-chromen-7-yl] ester Formula: C24H20O7S MolecularWeight: 452.4764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C24H20O7S/c1-15-4-9-19(10-5-15)32(26,27)31-18-8-6-17-12-20(24(25)30-22(17)14-18)16-7-11-21(28-2)23(13-16)29-3/h4-14H,1-3H3