4-(4-cyanophenyl)-1-propan-2-yl-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile

Systemtic Name: 4-(4-cyanophenyl)-1-propan-2-yl-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile Openeye Name: 4-(4-cyanophenyl)-1-isopropyl-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile CAS Name: 4-(4-cyanophenyl)-1-propan-2-yl-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile IUPAC Name: 4-(4-cyanophenyl)-1-propan-2-yl-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile Traditional Name: 4-(4-cyanophenyl)-1-isopropyl-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C12COC(OC1)(OC2C#N)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)C12COC(OC1)(OC2C#N)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H16N2O3/c1-11(2)15-9-19-16(20-10-15,21-14(15)8-18)13-5-3-12(7-17)4-6-13/h3-6,11,14H,9-10H2,1-2H3