3-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid

Systemtic Name: 3-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid Openeye Name: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid CAS Name: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2-methyl-5-imidazo[4,5-b]pyridinecarboxylic acid IUPAC Name: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2-methylimidazo[4,5-b]pyridine-5-carboxylic acid Traditional Name: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid Formula: C16H12ClN3O4 MolecularWeight: 345.73718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC4=C(C=C3Cl)OCO4)N=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NC2=C(N1CC3=CC4=C(C=C3Cl)OCO4)N=C(C=C2)C(=O)O

InChI

InChI=1S/C16H12ClN3O4/c1-8-18-11-2-3-12(16(21)22)19-15(11)20(8)6-9-4-13-14(5-10(9)17)24-7-23-13/h2-5H,6-7H2,1H3,(H,21,22)