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

Systemtic Name: methyl 3-[(2-chloranyl-4-propoxy-phenyl)methyl]-2-ethyl-imidazo[4,5-b]pyridine-5-carboxylate Openeye Name: methyl 3-[(2-chloro-4-propoxy-phenyl)methyl]-2-ethyl-imidazo[4,5-b]pyridine-5-carboxylate CAS Name: 3-[(2-chloro-4-propoxyphenyl)methyl]-2-ethyl-5-imidazo[4,5-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chloro-4-propoxyphenyl)methyl]-2-ethylimidazo[4,5-b]pyridine-5-carboxylate Traditional Name: 3-(2-chloro-4-propoxy-benzyl)-2-ethyl-imidazo[4,5-b]pyridine-5-carboxylic acid methyl ester Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O3/c1-4-10-27-14-7-6-13(15(21)11-14)12-24-18(5-2)22-16-8-9-17(20(25)26-3)23-19(16)24/h6-9,11H,4-5,10,12H2,1-3H3