4-[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]benzenecarbonitrile

Systemtic Name: 4-[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]benzenecarbonitrile Openeye Name: 4-[(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]benzonitrile CAS Name: 4-[(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]benzonitrile IUPAC Name: 4-[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzonitrile Traditional Name: 4-[(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]benzonitrile Formula: C22H25NO MolecularWeight: 319.44

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC2=CC=C(C=C2)C#N)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC2=CC=C(C=C2)C#N)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C22H25NO/c1-21(2,3)18-12-17(13-19(20(18)24)22(4,5)6)11-15-7-9-16(14-23)10-8-15/h7-13H,1-6H3