[2-[(5-bromanyl-2-butyl-imidazo[4,5-b]pyridin-3-yl)methyl]-6-phenyl-phenyl] tert-butyl carbonate

Systemtic Name: [2-[(5-bromanyl-2-butyl-imidazo[4,5-b]pyridin-3-yl)methyl]-6-phenyl-phenyl] tert-butyl carbonate Openeye Name: [2-[(5-bromo-2-butyl-imidazo[4,5-b]pyridin-3-yl)methyl]-6-phenyl-phenyl] tert-butyl carbonate CAS Name: carbonic acid [2-[(5-bromo-2-butyl-3-imidazo[4,5-b]pyridinyl)methyl]-6-phenylphenyl] tert-butyl ester IUPAC Name: [2-[(5-bromo-2-butylimidazo[4,5-b]pyridin-3-yl)methyl]-6-phenylphenyl] tert-butyl carbonate Traditional Name: carbonic acid [2-[(5-bromo-2-butyl-imidazo[4,5-b]pyridin-3-yl)methyl]-6-phenyl-phenyl] tert-butyl ester Formula: C28H30BrN3O3 MolecularWeight: 536.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)N=C(C=C2)Br

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)N=C(C=C2)Br

InChI

InChI=1S/C28H30BrN3O3/c1-5-6-15-24-30-22-16-17-23(29)31-26(22)32(24)18-20-13-10-14-21(19-11-8-7-9-12-19)25(20)34-27(33)35-28(2,3)4/h7-14,16-17H,5-6,15,18H2,1-4H3