1-[4-[(5-bromanyl-2-ethyl-7-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]cyclopent-3-ene-1-carboxylic acid

Systemtic Name: 1-[4-[(5-bromanyl-2-ethyl-7-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]cyclopent-3-ene-1-carboxylic acid Openeye Name: 1-[4-[(5-bromo-2-ethyl-7-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]cyclopent-3-ene-1-carboxylic acid CAS Name: 1-[4-[(5-bromo-2-ethyl-7-methyl-3-imidazo[4,5-b]pyridinyl)methyl]phenyl]-1-cyclopent-3-enecarboxylic acid IUPAC Name: 1-[4-[(5-bromo-2-ethyl-7-methylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]cyclopent-3-ene-1-carboxylic acid Traditional Name: 1-[4-[(5-bromo-2-ethyl-7-methyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]cyclopent-3-ene-1-carboxylic acid Formula: C22H22BrN3O2 MolecularWeight: 440.33298

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3=CC=C(C=C3)C4(CC=CC4)C(=O)O)N=C(C=C2C)Br

Isomeric SMILES

CCC1=NC2=C(N1CC3=CC=C(C=C3)C4(CC=CC4)C(=O)O)N=C(C=C2C)Br

InChI

InChI=1S/C22H22BrN3O2/c1-3-18-25-19-14(2)12-17(23)24-20(19)26(18)13-15-6-8-16(9-7-15)22(21(27)28)10-4-5-11-22/h4-9,12H,3,10-11,13H2,1-2H3,(H,27,28)