4-bromanyl-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-bromanyl-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-bromo-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one CAS Name: 4-bromo-2,6-ditert-butyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-bromo-2,6-ditert-butylcyclohexa-2,5-dien-1-one Traditional Name: 4-bromo-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Formula: C14H21BrO MolecularWeight: 285.21994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(C=C(C1=O)C(C)(C)C)Br

Isomeric SMILES

CC(C)(C)C1=CC(C=C(C1=O)C(C)(C)C)Br

InChI

InChI=1S/C14H21BrO/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7-9H,1-6H3