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

Systemtic Name: 2-[2-azanylidene-3-[(4-methylphenyl)methyl]benzimidazol-1-yl]-1-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanone hydrobromide Openeye Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[2-imino-3-(p-tolylmethyl)benzimidazol-1-yl]ethanone hydrobromide CAS Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[2-imino-3-[(4-methylphenyl)methyl]-1-benzimidazolyl]ethanone hydrobromide IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[2-imino-3-[(4-methylphenyl)methyl]benzimidazol-1-yl]ethanone hydrobromide Traditional Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[2-imino-3-(4-methylbenzyl)benzimidazol-1-yl]ethanone hydrobromide Formula: C31H38BrN3O2 MolecularWeight: 564.55632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC(=O)C4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C.Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC(=O)C4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C.Br

InChI

InChI=1S/C31H37N3O2.BrH/c1-20-12-14-21(15-13-20)18-33-25-10-8-9-11-26(25)34(29(33)32)19-27(35)22-16-23(30(2,3)4)28(36)24(17-22)31(5,6)7;/h8-17,32,36H,18-19H2,1-7H3;1H