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

Systemtic Name: 4-[(E)-2-cyano-4,4-dimethyl-3-oxidanylidene-pent-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-2-cyano-4,4-dimethyl-3-oxo-pent-1-enyl]benzonitrile CAS Name: 4-[(E)-2-cyano-4,4-dimethyl-3-oxopent-1-enyl]benzonitrile IUPAC Name: 4-[(E)-2-cyano-4,4-dimethyl-3-oxopent-1-enyl]benzonitrile Traditional Name: 4-[(E)-2-cyano-3-keto-4,4-dimethyl-pent-1-enyl]benzonitrile Formula: C15H14N2O MolecularWeight: 238.28446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O/c1-15(2,3)14(18)13(10-17)8-11-4-6-12(9-16)7-5-11/h4-8H,1-3H3/b13-8+