2,2-dimethyl-3-oxidanyl-4-(2-oxidanylidene-1H-pyridin-3-yl)-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-3-oxidanyl-4-(2-oxidanylidene-1H-pyridin-3-yl)-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2-dimethyl-4-(2-oxo-1H-pyridin-3-yl)chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-dimethyl-4-(2-oxo-1H-pyridin-3-yl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-4-(2-oxo-1H-pyridin-3-yl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-(2-keto-1H-pyridin-3-yl)-2,2-dimethyl-chroman-6-carbonitrile Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)C3=CC=CNC3=O)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)C3=CC=CNC3=O)O)C

InChI

InChI=1S/C17H16N2O3/c1-17(2)15(20)14(11-4-3-7-19-16(11)21)12-8-10(9-18)5-6-13(12)22-17/h3-8,14-15,20H,1-2H3,(H,19,21)