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

Systemtic Name: 3-[(2-chloranyl-4-propan-2-yloxy-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid Openeye Name: 3-[(2-chloro-4-isopropoxy-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid CAS Name: 3-[(2-chloro-4-propan-2-yloxyphenyl)methyl]-2-methyl-5-imidazo[4,5-b]pyridinecarboxylic acid IUPAC Name: 3-[(2-chloro-4-propan-2-yloxyphenyl)methyl]-2-methylimidazo[4,5-b]pyridine-5-carboxylic acid Traditional Name: 3-(2-chloro-4-isopropoxy-benzyl)-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3O3/c1-10(2)25-13-5-4-12(14(19)8-13)9-22-11(3)20-15-6-7-16(18(23)24)21-17(15)22/h4-8,10H,9H2,1-3H3,(H,23,24)