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

Systemtic Name: 1-[[2-(4-chlorophenyl)-7-methyl-imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[[2-(4-chlorophenyl)-7-methyl-imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[2-(4-chlorophenyl)-7-methyl-3-imidazo[1,2-a]pyridinyl]methyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[[2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[2-(4-chlorophenyl)-7-methyl-imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Formula: C21H22ClN3O2 MolecularWeight: 383.87128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(N2C=C1)C[NH+]3CCC(CC3)C(=O)[O-])C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC2=NC(=C(N2C=C1)C[NH+]3CCC(CC3)C(=O)[O-])C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O2/c1-14-6-11-25-18(13-24-9-7-16(8-10-24)21(26)27)20(23-19(25)12-14)15-2-4-17(22)5-3-15/h2-6,11-12,16H,7-10,13H2,1H3,(H,26,27)