[3-(4-chlorophenyl)-4-methyl-2-oxidanylidene-chromen-6-yl] benzenesulfonate

Systemtic Name: [3-(4-chlorophenyl)-4-methyl-2-oxidanylidene-chromen-6-yl] benzenesulfonate Openeye Name: [3-(4-chlorophenyl)-4-methyl-2-oxo-chromen-6-yl] benzenesulfonate CAS Name: benzenesulfonic acid [3-(4-chlorophenyl)-4-methyl-2-oxo-1-benzopyran-6-yl] ester IUPAC Name: [3-(4-chlorophenyl)-4-methyl-2-oxochromen-6-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-(4-chlorophenyl)-2-keto-4-methyl-chromen-6-yl] ester Formula: C22H15ClO5S MolecularWeight: 426.8695

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C(C=C2)OS(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C(C=C2)OS(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H15ClO5S/c1-14-19-13-17(28-29(25,26)18-5-3-2-4-6-18)11-12-20(19)27-22(24)21(14)15-7-9-16(23)10-8-15/h2-13H,1H3