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

Systemtic Name: [1-(6-cyano-2,2-dimethyl-chromen-4-yl)-5-(methylsulfonyloxymethyl)-2-oxidanylidene-pyridin-4-yl]methyl methanesulfonate Openeye Name: [1-(6-cyano-2,2-dimethyl-chromen-4-yl)-5-(methylsulfonyloxymethyl)-2-oxo-4-pyridyl]methyl methanesulfonate CAS Name: methanesulfonic acid [1-(6-cyano-2,2-dimethyl-1-benzopyran-4-yl)-5-(methylsulfonyloxymethyl)-2-oxo-4-pyridinyl]methyl ester IUPAC Name: [1-(6-cyano-2,2-dimethylchromen-4-yl)-5-(methylsulfonyloxymethyl)-2-oxopyridin-4-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-keto-5-(methylsulfonyloxymethyl)-4-pyridyl]methyl ester Formula: C21H22N2O8S2 MolecularWeight: 494.53798

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C(=CC3=O)COS(=O)(=O)C)COS(=O)(=O)C)C

Isomeric SMILES

CC1(C=C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C(=CC3=O)COS(=O)(=O)C)COS(=O)(=O)C)C

InChI

InChI=1S/C21H22N2O8S2/c1-21(2)9-18(17-7-14(10-22)5-6-19(17)31-21)23-11-16(13-30-33(4,27)28)15(8-20(23)24)12-29-32(3,25)26/h5-9,11H,12-13H2,1-4H3