1-[[7-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: 1-[[7-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[[7-methyl-2-(p-tolyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[7-methyl-2-(4-methylphenyl)-3-imidazo[1,2-a]pyridinyl]methyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[[7-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[7-methyl-2-(p-tolyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N3C=CC(=CC3=N2)C)C[NH+]4CCC(CC4)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N3C=CC(=CC3=N2)C)C[NH+]4CCC(CC4)C(=O)[O-]

InChI

InChI=1S/C22H25N3O2/c1-15-3-5-17(6-4-15)21-19(25-12-7-16(2)13-20(25)23-21)14-24-10-8-18(9-11-24)22(26)27/h3-7,12-13,18H,8-11,14H2,1-2H3,(H,26,27)