[3-(2-chloranyl-6-fluoranyl-phenyl)-2-methyl-4-oxidanylidene-chromen-7-yl] 4-methylsulfonylbenzoate

Systemtic Name: [3-(2-chloranyl-6-fluoranyl-phenyl)-2-methyl-4-oxidanylidene-chromen-7-yl] 4-methylsulfonylbenzoate Openeye Name: [3-(2-chloro-6-fluoro-phenyl)-2-methyl-4-oxo-chromen-7-yl] 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [3-(2-chloro-6-fluorophenyl)-2-methyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-chloro-6-fluorophenyl)-2-methyl-4-oxochromen-7-yl] 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [3-(2-chloro-6-fluoro-phenyl)-4-keto-2-methyl-chromen-7-yl] ester Formula: C24H16ClFO6S MolecularWeight: 486.896643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=C(C=C3)S(=O)(=O)C)C4=C(C=CC=C4Cl)F

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=C(C=C3)S(=O)(=O)C)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C24H16ClFO6S/c1-13-21(22-18(25)4-3-5-19(22)26)23(27)17-11-8-15(12-20(17)31-13)32-24(28)14-6-9-16(10-7-14)33(2,29)30/h3-12H,1-2H3