3-[(2-chloranyl-4-cyclohexyloxycarbonyl-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid

Systemtic Name: 3-[(2-chloranyl-4-cyclohexyloxycarbonyl-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid Openeye Name: 3-[[2-chloro-4-(cyclohexoxycarbonyl)phenyl]methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid CAS Name: 3-[[2-chloro-4-[cyclohexyloxy(oxo)methyl]phenyl]methyl]-2-methyl-5-imidazo[4,5-b]pyridinecarboxylic acid IUPAC Name: 3-[(2-chloro-4-cyclohexyloxycarbonylphenyl)methyl]-2-methylimidazo[4,5-b]pyridine-5-carboxylic acid Traditional Name: 3-[2-chloro-4-(cyclohexoxycarbonyl)benzyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=C(C=C(C=C3)C(=O)OC4CCCCC4)Cl)N=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NC2=C(N1CC3=C(C=C(C=C3)C(=O)OC4CCCCC4)Cl)N=C(C=C2)C(=O)O

InChI

InChI=1S/C22H22ClN3O4/c1-13-24-18-9-10-19(21(27)28)25-20(18)26(13)12-15-8-7-14(11-17(15)23)22(29)30-16-5-3-2-4-6-16/h7-11,16H,2-6,12H2,1H3,(H,27,28)