N-[1-[(3S,4R)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-2-oxidanylidene-pyridin-3-yl]ethanamide

Systemtic Name: N-[1-[(3S,4R)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-2-oxidanylidene-pyridin-3-yl]ethanamide Openeye Name: N-[1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]-2-oxo-3-pyridyl]acetamide CAS Name: N-[1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-oxo-3-pyridinyl]acetamide IUPAC Name: N-[1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-2-oxopyridin-3-yl]acetamide Traditional Name: N-[1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]-2-keto-3-pyridyl]acetamide Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CN(C1=O)C2C(C(OC3=C2C=C(C=C3)C#N)(C)C)O

Isomeric SMILES

CC(=O)NC1=CC=CN(C1=O)[C@H]2[C@@H](C(OC3=C2C=C(C=C3)C#N)(C)C)O

InChI

InChI=1S/C19H19N3O4/c1-11(23)21-14-5-4-8-22(18(14)25)16-13-9-12(10-20)6-7-15(13)26-19(2,3)17(16)24/h4-9,16-17,24H,1-3H3,(H,21,23)/t16-,17+/m1/s1