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

Systemtic Name: 1-[[2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[[2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[2-(3-methoxyphenyl)-3-imidazo[1,2-a]pyridinyl]methyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[[2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperidin-1-ium-4-carboxylate Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(N3C=CC=CC3=N2)C[NH+]4CCC(CC4)C(=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(N3C=CC=CC3=N2)C[NH+]4CCC(CC4)C(=O)[O-]

InChI

InChI=1S/C21H23N3O3/c1-27-17-6-4-5-16(13-17)20-18(24-10-3-2-7-19(24)22-20)14-23-11-8-15(9-12-23)21(25)26/h2-7,10,13,15H,8-9,11-12,14H2,1H3,(H,25,26)