[2-(2-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] benzenesulfonate

Systemtic Name: [2-(2-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] benzenesulfonate Openeye Name: [2-(2-chlorophenyl)-6,7-dimethyl-4-oxo-chromen-3-yl] benzenesulfonate CAS Name: benzenesulfonic acid [2-(2-chlorophenyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(2-chlorophenyl)-6,7-dimethyl-4-oxochromen-3-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-(2-chlorophenyl)-4-keto-6,7-dimethyl-chromen-3-yl] ester Formula: C23H17ClO5S MolecularWeight: 440.89608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=CC=C3Cl)OS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=CC=C3Cl)OS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C23H17ClO5S/c1-14-12-18-20(13-15(14)2)28-22(17-10-6-7-11-19(17)24)23(21(18)25)29-30(26,27)16-8-4-3-5-9-16/h3-13H,1-2H3