6-[6-bromanyl-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1H-benzimidazol-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[6-bromanyl-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1H-benzimidazol-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[6-bromo-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1H-benzimidazol-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[6-bromo-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1H-benzimidazol-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[6-bromo-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1H-benzimidazol-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[6-bromo-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1H-benzimidazol-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C27H29BrN2O2 MolecularWeight: 493.43536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N2C3=C(C=C(C=C3)Br)NC2=C4C=CC=CC4=O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N2C3=C(C=C(C=C3)Br)NC2=C4C=CC=CC4=O

InChI

InChI=1S/C27H29BrN2O2/c1-26(2,3)19-14-17(15-20(24(19)32)27(4,5)6)30-22-12-11-16(28)13-21(22)29-25(30)18-9-7-8-10-23(18)31/h7-15,29,32H,1-6H3