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

Systemtic Name: [2-[(2-butyl-5-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[(2-butyl-5-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[(2-butyl-5-methyl-3-imidazo[4,5-b]pyridinyl)methyl]-6-phenylphenyl] ester IUPAC Name: [2-[(2-butyl-5-methylimidazo[4,5-b]pyridin-3-yl)methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[(2-butyl-5-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]-6-phenyl-phenyl] ester Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O3/c1-3-4-13-22-27-21-15-14-17(2)26-24(21)28(22)16-19-11-8-12-20(23(19)31-25(29)30)18-9-6-5-7-10-18/h5-12,14-15H,3-4,13,16H2,1-2H3,(H,29,30)