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

Systemtic Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-6-methyl-imidazo[1,2-a]pyridine-2-carboxylate Openeye Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-6-methyl-imidazo[1,2-a]pyridine-2-carboxylate CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)methyl]-6-methyl-2-imidazo[1,2-a]pyridinecarboxylate IUPAC Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-6-methylimidazo[1,2-a]pyridine-2-carboxylate Traditional Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-6-methyl-imidazo[1,2-a]pyridine-2-carboxylate Formula: C16H22N4O2 MolecularWeight: 302.37148

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=C(N=C3N2C=C(C=C3)C)C(=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=C(N=C3N2C=C(C=C3)C)C(=O)[O-]

InChI

InChI=1S/C16H22N4O2/c1-3-18-6-8-19(9-7-18)11-13-15(16(21)22)17-14-5-4-12(2)10-20(13)14/h4-5,10H,3,6-9,11H2,1-2H3,(H,21,22)