phenyl 2-[4,4-dimethyl-2,6-bis(oxidanylidene)-1-(2-phenoxysulfonylethyl)cyclohexyl]ethanesulfonate

Systemtic Name: phenyl 2-[4,4-dimethyl-2,6-bis(oxidanylidene)-1-(2-phenoxysulfonylethyl)cyclohexyl]ethanesulfonate Openeye Name: phenyl 2-[4,4-dimethyl-2,6-dioxo-1-(2-phenoxysulfonylethyl)cyclohexyl]ethanesulfonate CAS Name: 2-[4,4-dimethyl-2,6-dioxo-1-(2-phenoxysulfonylethyl)cyclohexyl]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-[4,4-dimethyl-2,6-dioxo-1-(2-phenoxysulfonylethyl)cyclohexyl]ethanesulfonate Traditional Name: 2-[2,6-diketo-4,4-dimethyl-1-(2-phenoxysulfonylethyl)cyclohexyl]ethanesulfonic acid phenyl ester Formula: C24H28O8S2 MolecularWeight: 508.60432

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)(CCS(=O)(=O)OC2=CC=CC=C2)CCS(=O)(=O)OC3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)(CCS(=O)(=O)OC2=CC=CC=C2)CCS(=O)(=O)OC3=CC=CC=C3)C

InChI

InChI=1S/C24H28O8S2/c1-23(2)17-21(25)24(22(26)18-23,13-15-33(27,28)31-19-9-5-3-6-10-19)14-16-34(29,30)32-20-11-7-4-8-12-20/h3-12H,13-18H2,1-2H3