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

Systemtic Name: 3-[(2-chloranyl-4-propoxy-phenyl)methyl]-2-ethyl-imidazo[4,5-b]pyridine-5-carboxylic acid Openeye Name: 3-[(2-chloro-4-propoxy-phenyl)methyl]-2-ethyl-imidazo[4,5-b]pyridine-5-carboxylic acid CAS Name: 3-[(2-chloro-4-propoxyphenyl)methyl]-2-ethyl-5-imidazo[4,5-b]pyridinecarboxylic acid IUPAC Name: 3-[(2-chloro-4-propoxyphenyl)methyl]-2-ethylimidazo[4,5-b]pyridine-5-carboxylic acid Traditional Name: 3-(2-chloro-4-propoxy-benzyl)-2-ethyl-imidazo[4,5-b]pyridine-5-carboxylic acid Formula: C19H20ClN3O3 MolecularWeight: 373.8334

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)CN2C(=NC3=C2N=C(C=C3)C(=O)O)CC)Cl

Isomeric SMILES

CCCOC1=CC(=C(C=C1)CN2C(=NC3=C2N=C(C=C3)C(=O)O)CC)Cl

InChI

InChI=1S/C19H20ClN3O3/c1-3-9-26-13-6-5-12(14(20)10-13)11-23-17(4-2)21-15-7-8-16(19(24)25)22-18(15)23/h5-8,10H,3-4,9,11H2,1-2H3,(H,24,25)