ethyl 1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-2-oxidanylidene-pyridine-4-carboxylate

Systemtic Name: ethyl 1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-2-oxidanylidene-pyridine-4-carboxylate Openeye Name: ethyl 1-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-2-oxo-pyridine-4-carboxylate CAS Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-2-oxo-4-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-2-oxopyridine-4-carboxylate Traditional Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-2-keto-isonicotinic acid ethyl ester Formula: C20H20N2O5 MolecularWeight: 368.3832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O5/c1-4-26-19(25)13-7-8-22(16(23)10-13)17-14-9-12(11-21)5-6-15(14)27-20(2,3)18(17)24/h5-10,17-18,24H,4H2,1-3H3