methyl 2-[4-[(6-bromanyl-2-butyl-7-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[(6-bromanyl-2-butyl-7-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[(6-bromo-2-butyl-7-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoate CAS Name: 2-[4-[(6-bromo-2-butyl-7-methyl-3-imidazo[4,5-b]pyridinyl)methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(6-bromo-2-butyl-7-methylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoate Traditional Name: 2-[4-[(6-bromo-2-butyl-7-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoic acid methyl ester Formula: C26H26BrN3O2 MolecularWeight: 492.40754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=CN=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)Br)C

Isomeric SMILES

CCCCC1=NC2=C(C(=CN=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)Br)C

InChI

InChI=1S/C26H26BrN3O2/c1-4-5-10-23-29-24-17(2)22(27)15-28-25(24)30(23)16-18-11-13-19(14-12-18)20-8-6-7-9-21(20)26(31)32-3/h6-9,11-15H,4-5,10,16H2,1-3H3