[6-cyano-2,2-dimethyl-4-[4-(1-methylsulfonyloxyethyl)-2-oxidanylidene-pyridin-1-yl]-3,4-dihydrochromen-3-yl] ethanoate

Systemtic Name: [6-cyano-2,2-dimethyl-4-[4-(1-methylsulfonyloxyethyl)-2-oxidanylidene-pyridin-1-yl]-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [6-cyano-2,2-dimethyl-4-[4-(1-methylsulfonyloxyethyl)-2-oxo-1-pyridyl]chroman-3-yl] acetate CAS Name: acetic acid [6-cyano-2,2-dimethyl-4-[4-(1-methylsulfonyloxyethyl)-2-oxo-1-pyridinyl]-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-cyano-2,2-dimethyl-4-[4-(1-methylsulfonyloxyethyl)-2-oxopyridin-1-yl]-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [6-cyano-4-[2-keto-4-(1-methylsulfonyloxyethyl)-1-pyridyl]-2,2-dimethyl-chroman-3-yl] ester Formula: C22H24N2O7S MolecularWeight: 460.50016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=O)N(C=C1)C2C(C(OC3=C2C=C(C=C3)C#N)(C)C)OC(=O)C)OS(=O)(=O)C

Isomeric SMILES

CC(C1=CC(=O)N(C=C1)C2C(C(OC3=C2C=C(C=C3)C#N)(C)C)OC(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C22H24N2O7S/c1-13(31-32(5,27)28)16-8-9-24(19(26)11-16)20-17-10-15(12-23)6-7-18(17)30-22(3,4)21(20)29-14(2)25/h6-11,13,20-21H,1-5H3