[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-5-methyl-4-methylsulfonyloxy-6-oxidanylidene-pyridin-3-yl] methanesulfonate

Systemtic Name: [1-(6-cyano-2,2-dimethyl-chromen-4-yl)-5-methyl-4-methylsulfonyloxy-6-oxidanylidene-pyridin-3-yl] methanesulfonate Openeye Name: [1-(6-cyano-2,2-dimethyl-chromen-4-yl)-5-methyl-4-methylsulfonyloxy-6-oxo-3-pyridyl] methanesulfonate CAS Name: methanesulfonic acid [1-(6-cyano-2,2-dimethyl-1-benzopyran-4-yl)-5-methyl-4-methylsulfonyloxy-6-oxo-3-pyridinyl] ester IUPAC Name: [1-(6-cyano-2,2-dimethylchromen-4-yl)-5-methyl-4-methylsulfonyloxy-6-oxopyridin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-(6-cyano-2,2-dimethyl-chromen-4-yl)-6-keto-5-methyl-4-methylsulfonyloxy-3-pyridyl] ester Formula: C20H20N2O8S2 MolecularWeight: 480.5114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN(C1=O)C2=CC(OC3=C2C=C(C=C3)C#N)(C)C)OS(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

CC1=C(C(=CN(C1=O)C2=CC(OC3=C2C=C(C=C3)C#N)(C)C)OS(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C20H20N2O8S2/c1-12-18(30-32(5,26)27)17(29-31(4,24)25)11-22(19(12)23)15-9-20(2,3)28-16-7-6-13(10-21)8-14(15)16/h6-9,11H,1-5H3