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

Systemtic Name: [6-cyano-2,2-dimethyl-4-[4-(2-methylsulfonyloxyethyl)-2-oxidanylidene-pyridin-1-yl]-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [6-cyano-2,2-dimethyl-4-[4-(2-methylsulfonyloxyethyl)-2-oxo-1-pyridyl]chroman-3-yl] acetate CAS Name: acetic acid [6-cyano-2,2-dimethyl-4-[4-(2-methylsulfonyloxyethyl)-2-oxo-1-pyridinyl]-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-cyano-2,2-dimethyl-4-[4-(2-methylsulfonyloxyethyl)-2-oxopyridin-1-yl]-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [6-cyano-4-[2-keto-4-(2-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(=O)OC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3C=CC(=CC3=O)CCOS(=O)(=O)C

Isomeric SMILES

CC(=O)OC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3C=CC(=CC3=O)CCOS(=O)(=O)C

InChI

InChI=1S/C22H24N2O7S/c1-14(25)30-21-20(17-11-16(13-23)5-6-18(17)31-22(21,2)3)24-9-7-15(12-19(24)26)8-10-29-32(4,27)28/h5-7,9,11-12,20-21H,8,10H2,1-4H3