2-[4-[(5-azanyl-2-butyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[(5-azanyl-2-butyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(5-amino-2-butyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[(5-amino-2-butyl-3-imidazo[4,5-b]pyridinyl)methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[(5-amino-2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(5-amino-2-butyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoic acid Formula: C24H24N4O2 MolecularWeight: 400.47296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)N=C(C=C2)N

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)N=C(C=C2)N

InChI

InChI=1S/C24H24N4O2/c1-2-3-8-22-26-20-13-14-21(25)27-23(20)28(22)15-16-9-11-17(12-10-16)18-6-4-5-7-19(18)24(29)30/h4-7,9-14H,2-3,8,15H2,1H3,(H2,25,27)(H,29,30)