3-[3-(2-cyanoethyl)-2-(oxan-4-yl)-4-oxidanylidene-2H-chromen-3-yl]propanenitrile

Systemtic Name: 3-[3-(2-cyanoethyl)-2-(oxan-4-yl)-4-oxidanylidene-2H-chromen-3-yl]propanenitrile Openeye Name: 3-[3-(2-cyanoethyl)-4-oxo-2-tetrahydropyran-4-yl-chroman-3-yl]propanenitrile CAS Name: 3-[3-(2-cyanoethyl)-2-(4-oxanyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl]propanenitrile IUPAC Name: 3-[3-(2-cyanoethyl)-2-(oxan-4-yl)-4-oxo-2H-chromen-3-yl]propanenitrile Traditional Name: 3-[3-(2-cyanoethyl)-4-keto-2-tetrahydropyran-4-yl-chroman-3-yl]propionitrile Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C2C(C(=O)C3=CC=CC=C3O2)(CCC#N)CCC#N

Isomeric SMILES

C1COCCC1C2C(C(=O)C3=CC=CC=C3O2)(CCC#N)CCC#N

InChI

InChI=1S/C20H22N2O3/c21-11-3-9-20(10-4-12-22)18(23)16-5-1-2-6-17(16)25-19(20)15-7-13-24-14-8-15/h1-2,5-6,15,19H,3-4,7-10,13-14H2