ethyl 3-[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-oxidanylidene-pyridin-4-yl]-3-oxidanyl-propanoate

Systemtic Name: ethyl 3-[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-oxidanylidene-pyridin-4-yl]-3-oxidanyl-propanoate Openeye Name: ethyl 3-[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-oxo-4-pyridyl]-3-hydroxy-propanoate CAS Name: 3-[1-(6-cyano-2,2-dimethyl-1-benzopyran-4-yl)-2-oxo-4-pyridinyl]-3-hydroxypropanoic acid ethyl ester IUPAC Name: ethyl 3-[1-(6-cyano-2,2-dimethylchromen-4-yl)-2-oxopyridin-4-yl]-3-hydroxypropanoate Traditional Name: 3-[1-(6-cyano-2,2-dimethyl-chromen-4-yl)-2-keto-4-pyridyl]-3-hydroxy-propionic acid ethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC(=O)N(C=C1)C2=CC(OC3=C2C=C(C=C3)C#N)(C)C)O

Isomeric SMILES

CCOC(=O)CC(C1=CC(=O)N(C=C1)C2=CC(OC3=C2C=C(C=C3)C#N)(C)C)O

InChI

InChI=1S/C22H22N2O5/c1-4-28-21(27)11-18(25)15-7-8-24(20(26)10-15)17-12-22(2,3)29-19-6-5-14(13-23)9-16(17)19/h5-10,12,18,25H,4,11H2,1-3H3