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

Systemtic Name: 2,2-dimethyl-4-[4-(4-oxidanylbutyl)-2-oxidanylidene-pyridin-1-yl]chromene-6-carbonitrile Openeye Name: 4-[4-(4-hydroxybutyl)-2-oxo-1-pyridyl]-2,2-dimethyl-chromene-6-carbonitrile CAS Name: 4-[4-(4-hydroxybutyl)-2-oxo-1-pyridinyl]-2,2-dimethyl-1-benzopyran-6-carbonitrile IUPAC Name: 4-[4-(4-hydroxybutyl)-2-oxopyridin-1-yl]-2,2-dimethylchromene-6-carbonitrile Traditional Name: 4-[4-(4-hydroxybutyl)-2-keto-1-pyridyl]-2,2-dimethyl-chromene-6-carbonitrile Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O3/c1-21(2)13-18(17-11-16(14-22)6-7-19(17)26-21)23-9-8-15(12-20(23)25)5-3-4-10-24/h6-9,11-13,24H,3-5,10H2,1-2H3