2,2-dimethyl-3-oxidanyl-4-[2-oxidanylidene-5-(phenylmethoxymethyl)pyridin-1-yl]-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-3-oxidanyl-4-[2-oxidanylidene-5-(phenylmethoxymethyl)pyridin-1-yl]-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[5-(benzyloxymethyl)-2-oxo-1-pyridyl]-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-dimethyl-4-[2-oxo-5-(phenylmethoxymethyl)-1-pyridinyl]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-4-[2-oxo-5-(phenylmethoxymethyl)pyridin-1-yl]-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[5-(benzoxymethyl)-2-keto-1-pyridyl]-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C25H24N2O4 MolecularWeight: 416.46906

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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)COCC4=CC=CC=C4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C=CC3=O)COCC4=CC=CC=C4)O)C

InChI

InChI=1S/C25H24N2O4/c1-25(2)24(29)23(20-12-18(13-26)8-10-21(20)31-25)27-14-19(9-11-22(27)28)16-30-15-17-6-4-3-5-7-17/h3-12,14,23-24,29H,15-16H2,1-2H3