4-[4,5-bis(hydroxymethyl)-2-oxidanylidene-pyridin-1-yl]-2,2-dimethyl-chromene-6-carbonitrile

Systemtic Name: 4-[4,5-bis(hydroxymethyl)-2-oxidanylidene-pyridin-1-yl]-2,2-dimethyl-chromene-6-carbonitrile Openeye Name: 4-[4,5-bis(hydroxymethyl)-2-oxo-1-pyridyl]-2,2-dimethyl-chromene-6-carbonitrile CAS Name: 4-[4,5-bis(hydroxymethyl)-2-oxo-1-pyridinyl]-2,2-dimethyl-1-benzopyran-6-carbonitrile IUPAC Name: 4-[4,5-bis(hydroxymethyl)-2-oxopyridin-1-yl]-2,2-dimethylchromene-6-carbonitrile Traditional Name: 4-(2-keto-4,5-dimethylol-1-pyridyl)-2,2-dimethyl-chromene-6-carbonitrile Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O4/c1-19(2)7-16(15-5-12(8-20)3-4-17(15)25-19)21-9-14(11-23)13(10-22)6-18(21)24/h3-7,9,22-23H,10-11H2,1-2H3