6-methyl-3-[(4-methylpiperazin-4-ium-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxylate

Systemtic Name: 6-methyl-3-[(4-methylpiperazin-4-ium-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxylate Openeye Name: 6-methyl-3-[(4-methylpiperazin-4-ium-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxylate CAS Name: 6-methyl-3-[(4-methyl-1-piperazin-4-iumyl)methyl]-2-imidazo[1,2-a]pyridinecarboxylate IUPAC Name: 6-methyl-3-[(4-methylpiperazin-4-ium-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxylate Traditional Name: 6-methyl-3-[(4-methylpiperazin-4-ium-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxylate Formula: C15H20N4O2 MolecularWeight: 288.3449

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=C2CN3CC[NH+](CC3)C)C(=O)[O-])C=C1

Isomeric SMILES

CC1=CN2C(=NC(=C2CN3CC[NH+](CC3)C)C(=O)[O-])C=C1

InChI

InChI=1S/C15H20N4O2/c1-11-3-4-13-16-14(15(20)21)12(19(13)9-11)10-18-7-5-17(2)6-8-18/h3-4,9H,5-8,10H2,1-2H3,(H,20,21)