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

Systemtic Name: [4-[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-oxidanylidene-pyridin-4-yl]-4-methylsulfonyloxy-butyl] methanesulfonate Openeye Name: [4-[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-oxo-4-pyridyl]-4-methylsulfonyloxy-butyl] methanesulfonate CAS Name: methanesulfonic acid [4-[1-(6-cyano-2,2-dimethyl-1-benzopyran-4-yl)-2-oxo-4-pyridinyl]-4-methylsulfonyloxybutyl] ester IUPAC Name: [4-[1-(6-cyano-2,2-dimethylchromen-4-yl)-2-oxopyridin-4-yl]-4-methylsulfonyloxybutyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-keto-4-pyridyl]-4-methylsulfonyloxy-butyl] ester Formula: C23H26N2O8S2 MolecularWeight: 522.59114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O8S2/c1-23(2)14-19(18-12-16(15-24)7-8-21(18)32-23)25-10-9-17(13-22(25)26)20(33-35(4,29)30)6-5-11-31-34(3,27)28/h7-10,12-14,20H,5-6,11H2,1-4H3