3-[[tert-butyl(ethyl)azaniumyl]methyl]-6-chloranyl-imidazo[1,2-a]pyridine-2-carboxylate

Systemtic Name: 3-[[tert-butyl(ethyl)azaniumyl]methyl]-6-chloranyl-imidazo[1,2-a]pyridine-2-carboxylate Openeye Name: 3-[[tert-butyl(ethyl)ammonio]methyl]-6-chloro-imidazo[1,2-a]pyridine-2-carboxylate CAS Name: 3-[[tert-butyl(ethyl)ammonio]methyl]-6-chloro-2-imidazo[1,2-a]pyridinecarboxylate IUPAC Name: 3-[[tert-butyl(ethyl)azaniumyl]methyl]-6-chloroimidazo[1,2-a]pyridine-2-carboxylate Traditional Name: 3-[[tert-butyl(ethyl)ammonio]methyl]-6-chloro-imidazo[1,2-a]pyridine-2-carboxylate Formula: C15H20ClN3O2 MolecularWeight: 309.7912

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=C(N=C2N1C=C(C=C2)Cl)C(=O)[O-])C(C)(C)C

Isomeric SMILES

CC[NH+](CC1=C(N=C2N1C=C(C=C2)Cl)C(=O)[O-])C(C)(C)C

InChI

InChI=1S/C15H20ClN3O2/c1-5-18(15(2,3)4)9-11-13(14(20)21)17-12-7-6-10(16)8-19(11)12/h6-8H,5,9H2,1-4H3,(H,20,21)