1-[[2-(4-methoxyphenyl)-8-methyl-imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: 1-[[2-(4-methoxyphenyl)-8-methyl-imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[[2-(4-methoxyphenyl)-8-methyl-imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[2-(4-methoxyphenyl)-8-methyl-3-imidazo[1,2-a]pyridinyl]methyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[[2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[2-(4-methoxyphenyl)-8-methyl-imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C2C[NH+]3CCC(CC3)C(=O)[O-])C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CN2C1=NC(=C2C[NH+]3CCC(CC3)C(=O)[O-])C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H25N3O3/c1-15-4-3-11-25-19(14-24-12-9-17(10-13-24)22(26)27)20(23-21(15)25)16-5-7-18(28-2)8-6-16/h3-8,11,17H,9-10,12-14H2,1-2H3,(H,26,27)