methyl 3-[1-(2-chlorophenyl)hexyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate

Systemtic Name: methyl 3-[1-(2-chlorophenyl)hexyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate Openeye Name: methyl 3-[1-(2-chlorophenyl)hexyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate CAS Name: 3-[1-(2-chlorophenyl)hexyl]-2-methyl-5-imidazo[4,5-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[1-(2-chlorophenyl)hexyl]-2-methylimidazo[4,5-b]pyridine-5-carboxylate Traditional Name: 3-[1-(2-chlorophenyl)hexyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid methyl ester Formula: C21H24ClN3O2 MolecularWeight: 385.88716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=CC=C1Cl)N2C(=NC3=C2N=C(C=C3)C(=O)OC)C

Isomeric SMILES

CCCCCC(C1=CC=CC=C1Cl)N2C(=NC3=C2N=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C21H24ClN3O2/c1-4-5-6-11-19(15-9-7-8-10-16(15)22)25-14(2)23-17-12-13-18(21(26)27-3)24-20(17)25/h7-10,12-13,19H,4-6,11H2,1-3H3