[4,6-dimethyl-7,8-bis(oxidanylidene)-1,9-di(propan-2-yl)dibenzo-p-dioxin-2-yl] methanesulfonate

Systemtic Name: [4,6-dimethyl-7,8-bis(oxidanylidene)-1,9-di(propan-2-yl)dibenzo-p-dioxin-2-yl] methanesulfonate Openeye Name: (1,9-diisopropyl-4,6-dimethyl-7,8-dioxo-dibenzo-p-dioxin-2-yl) methanesulfonate CAS Name: methanesulfonic acid [4,6-dimethyl-7,8-dioxo-1,9-di(propan-2-yl)-2-dibenzo-p-dioxinyl] ester IUPAC Name: [4,6-dimethyl-7,8-dioxo-1,9-di(propan-2-yl)dibenzo-p-dioxin-2-yl] methanesulfonate Traditional Name: methanesulfonic acid (1,9-diisopropyl-7,8-diketo-4,6-dimethyl-dibenzo-p-dioxin-2-yl) ester Formula: C21H24O7S MolecularWeight: 420.47606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1OC3=C(C(=O)C(=O)C(=C3O2)C(C)C)C)C(C)C)OS(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C2=C1OC3=C(C(=O)C(=O)C(=C3O2)C(C)C)C)C(C)C)OS(=O)(=O)C

InChI

InChI=1S/C21H24O7S/c1-9(2)14-13(28-29(7,24)25)8-11(5)18-20(14)27-21-15(10(3)4)17(23)16(22)12(6)19(21)26-18/h8-10H,1-7H3