2-[3-[2-[2-cyclopentyl-4,6-bis(oxidanylidene)oxan-2-yl]ethyl]phenyl]-2-methyl-propanenitrile

Systemtic Name: 2-[3-[2-[2-cyclopentyl-4,6-bis(oxidanylidene)oxan-2-yl]ethyl]phenyl]-2-methyl-propanenitrile Openeye Name: 2-[3-[2-(2-cyclopentyl-4,6-dioxo-tetrahydropyran-2-yl)ethyl]phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-[2-(2-cyclopentyl-4,6-dioxo-2-oxanyl)ethyl]phenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-[2-(2-cyclopentyl-4,6-dioxooxan-2-yl)ethyl]phenyl]-2-methylpropanenitrile Traditional Name: 2-[3-[2-(2-cyclopentyl-4,6-diketo-tetrahydropyran-2-yl)ethyl]phenyl]-2-methyl-propionitrile Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC=CC(=C1)CCC2(CC(=O)CC(=O)O2)C3CCCC3

Isomeric SMILES

CC(C)(C#N)C1=CC=CC(=C1)CCC2(CC(=O)CC(=O)O2)C3CCCC3

InChI

InChI=1S/C22H27NO3/c1-21(2,15-23)18-9-5-6-16(12-18)10-11-22(17-7-3-4-8-17)14-19(24)13-20(25)26-22/h5-6,9,12,17H,3-4,7-8,10-11,13-14H2,1-2H3