(7-chloranyl-6,9-dimethoxy-2-methyl-4-oxidanylidene-benzo[g]chromen-5-yl) 4-methylbenzenesulfonate

Systemtic Name: (7-chloranyl-6,9-dimethoxy-2-methyl-4-oxidanylidene-benzo[g]chromen-5-yl) 4-methylbenzenesulfonate Openeye Name: (7-chloro-6,9-dimethoxy-2-methyl-4-oxo-benzo[g]chromen-5-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (7-chloro-6,9-dimethoxy-2-methyl-4-oxo-5-benzo[g][1]benzopyranyl) ester IUPAC Name: (7-chloro-6,9-dimethoxy-2-methyl-4-oxobenzo[g]chromen-5-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (7-chloro-4-keto-6,9-dimethoxy-2-methyl-benzo[g]chromen-5-yl) ester Formula: C23H19ClO7S MolecularWeight: 474.91076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=CC4=C2C(=O)C=C(O4)C)C(=CC(=C3OC)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=CC4=C2C(=O)C=C(O4)C)C(=CC(=C3OC)Cl)OC

InChI

InChI=1S/C23H19ClO7S/c1-12-5-7-14(8-6-12)32(26,27)31-23-20-15(18(28-3)11-16(24)22(20)29-4)10-19-21(23)17(25)9-13(2)30-19/h5-11H,1-4H3