4-[[(3-bromophenyl)diazenyl]methylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[(3-bromophenyl)diazenyl]methylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[(3-bromophenyl)azomethylene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one CAS Name: 4-[(3-bromophenyl)azomethylidene]-2,6-ditert-butyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(3-bromophenyl)diazenyl]methylidene]-2,6-ditert-butylcyclohexa-2,5-dien-1-one Traditional Name: 4-[(3-bromophenyl)azomethylene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Formula: C21H25BrN2O MolecularWeight: 401.34

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CN=NC2=CC(=CC=C2)Br)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CN=NC2=CC(=CC=C2)Br)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C21H25BrN2O/c1-20(2,3)17-10-14(11-18(19(17)25)21(4,5)6)13-23-24-16-9-7-8-15(22)12-16/h7-13H,1-6H3