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

Systemtic Name: 2-[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-oxidanylidene-pyridin-4-yl]ethyl methanesulfonate Openeye Name: 2-[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-oxo-4-pyridyl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[1-(6-cyano-2,2-dimethyl-1-benzopyran-4-yl)-2-oxo-4-pyridinyl]ethyl ester IUPAC Name: 2-[1-(6-cyano-2,2-dimethylchromen-4-yl)-2-oxopyridin-4-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-keto-4-pyridyl]ethyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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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)CCOS(=O)(=O)C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O5S/c1-20(2)12-17(16-10-15(13-21)4-5-18(16)27-20)22-8-6-14(11-19(22)23)7-9-26-28(3,24)25/h4-6,8,10-12H,7,9H2,1-3H3