[3-[6-(5-bromanyl-1-methyl-benzimidazol-2-yl)-2-butyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [3-[6-(5-bromanyl-1-methyl-benzimidazol-2-yl)-2-butyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [3-[6-(5-bromo-1-methyl-benzimidazol-2-yl)-2-butyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [3-[6-(5-bromo-1-methyl-2-benzimidazolyl)-2-butyl-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: [3-[6-(5-bromo-1-methylbenzimidazol-2-yl)-2-butylbenzimidazol-1-yl]-2-methyl-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [3-[6-(5-bromo-1-methyl-benzimidazol-2-yl)-2-butyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C33H29BrN4O3 MolecularWeight: 609.51236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)C=C(C=C2)C5=NC6=C(N5C)C=CC(=C6)Br

Isomeric SMILES

CCCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)C=C(C=C2)C5=NC6=C(N5C)C=CC(=C6)Br

InChI

InChI=1S/C33H29BrN4O3/c1-4-5-11-30-35-25-15-12-22(32-36-26-19-23(34)13-16-28(26)37(32)3)18-29(25)38(30)27-17-14-24(21-9-7-6-8-10-21)31(20(27)2)41-33(39)40/h6-10,12-19H,4-5,11H2,1-3H3,(H,39,40)