3-[[3-[(E)-2-cyano-4,4-dimethyl-3-oxidanylidene-pent-1-enyl]phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 3-[[3-[(E)-2-cyano-4,4-dimethyl-3-oxidanylidene-pent-1-enyl]phenoxy]methyl]benzenecarbonitrile Openeye Name: 3-[[3-[(E)-2-cyano-4,4-dimethyl-3-oxo-pent-1-enyl]phenoxy]methyl]benzonitrile CAS Name: 3-[[3-[(E)-2-cyano-4,4-dimethyl-3-oxopent-1-enyl]phenoxy]methyl]benzonitrile IUPAC Name: 3-[[3-[(E)-2-cyano-4,4-dimethyl-3-oxopent-1-enyl]phenoxy]methyl]benzonitrile Traditional Name: 3-[[3-[(E)-2-cyano-3-keto-4,4-dimethyl-pent-1-enyl]phenoxy]methyl]benzonitrile Formula: C22H20N2O2 MolecularWeight: 344.4064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC(=CC=C1)OCC2=CC=CC(=C2)C#N)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/C1=CC(=CC=C1)OCC2=CC=CC(=C2)C#N)/C#N

InChI

InChI=1S/C22H20N2O2/c1-22(2,3)21(25)19(14-24)11-16-6-5-9-20(12-16)26-15-18-8-4-7-17(10-18)13-23/h4-12H,15H2,1-3H3/b19-11+