2-[2-azanylidene-3-[(4-tert-butylphenyl)methyl]benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone hydrobromide

Systemtic Name: 2-[2-azanylidene-3-[(4-tert-butylphenyl)methyl]benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone hydrobromide Openeye Name: 2-[3-[(4-tert-butylphenyl)methyl]-2-imino-benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone hydrobromide CAS Name: 2-[3-[(4-tert-butylphenyl)methyl]-2-imino-1-benzimidazolyl]-1-(4-nitrophenyl)ethanone hydrobromide IUPAC Name: 2-[3-[(4-tert-butylphenyl)methyl]-2-iminobenzimidazol-1-yl]-1-(4-nitrophenyl)ethanone hydrobromide Traditional Name: 2-[3-(4-tert-butylbenzyl)-2-imino-benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone hydrobromide Formula: C26H27BrN4O3 MolecularWeight: 523.42158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC(=O)C4=CC=C(C=C4)[N+](=O)[O-].Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC(=O)C4=CC=C(C=C4)[N+](=O)[O-].Br

InChI

InChI=1S/C26H26N4O3.BrH/c1-26(2,3)20-12-8-18(9-13-20)16-28-22-6-4-5-7-23(22)29(25(28)27)17-24(31)19-10-14-21(15-11-19)30(32)33;/h4-15,27H,16-17H2,1-3H3;1H