1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[2-(3-oxidanylpropylamino)benzimidazol-1-yl]ethanone hydrobromide

Systemtic Name: 1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[2-(3-oxidanylpropylamino)benzimidazol-1-yl]ethanone hydrobromide Openeye Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[2-(3-hydroxypropylamino)benzimidazol-1-yl]ethanone hydrobromide CAS Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[2-(3-hydroxypropylamino)-1-benzimidazolyl]ethanone hydrobromide IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[2-(3-hydroxypropylamino)benzimidazol-1-yl]ethanone hydrobromide Traditional Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[2-(3-hydroxypropylamino)benzimidazol-1-yl]ethanone hydrobromide Formula: C26H36BrN3O3 MolecularWeight: 518.48634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2C3=CC=CC=C3N=C2NCCCO.Br

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2C3=CC=CC=C3N=C2NCCCO.Br

InChI

InChI=1S/C26H35N3O3.BrH/c1-25(2,3)18-14-17(15-19(23(18)32)26(4,5)6)22(31)16-29-21-11-8-7-10-20(21)28-24(29)27-12-9-13-30;/h7-8,10-11,14-15,30,32H,9,12-13,16H2,1-6H3,(H,27,28);1H