2-[3-bromanyl-5-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]indazol-2-yl]benzoic acid

Systemtic Name: 2-[3-bromanyl-5-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]indazol-2-yl]benzoic acid Openeye Name: 2-[3-bromo-5-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]indazol-2-yl]benzoic acid CAS Name: 2-[3-bromo-5-[(2-butyl-3-imidazo[4,5-b]pyridinyl)methyl]-2-indazolyl]benzoic acid IUPAC Name: 2-[3-bromo-5-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]indazol-2-yl]benzoic acid Traditional Name: 2-[3-bromo-5-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]indazol-2-yl]benzoic acid Formula: C25H22BrN5O2 MolecularWeight: 504.37848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC4=C(N(N=C4C=C3)C5=CC=CC=C5C(=O)O)Br)N=CC=C2

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC4=C(N(N=C4C=C3)C5=CC=CC=C5C(=O)O)Br)N=CC=C2

InChI

InChI=1S/C25H22BrN5O2/c1-2-3-10-22-28-20-8-6-13-27-24(20)30(22)15-16-11-12-19-18(14-16)23(26)31(29-19)21-9-5-4-7-17(21)25(32)33/h4-9,11-14H,2-3,10,15H2,1H3,(H,32,33)