2-[5-methyl-3-(piperidin-1-ylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]ethanoic acid

Systemtic Name: 2-[5-methyl-3-(piperidin-1-ylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]ethanoic acid Openeye Name: 2-[5-methyl-3-(1-piperidylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid CAS Name: 2-[5-methyl-3-(1-piperidinylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid IUPAC Name: 2-[5-methyl-3-(piperidin-1-ylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid Traditional Name: 2-[5-methyl-3-(piperidinomethyl)-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid Formula: C16H22N3O2+ MolecularWeight: 288.36478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C(=CC=C1)NC(=C2CN3CCCCC3)CC(=O)O

Isomeric SMILES

CC1=[N+]2C(=CC=C1)NC(=C2CN3CCCCC3)CC(=O)O

InChI

InChI=1S/C16H21N3O2/c1-12-6-5-7-15-17-13(10-16(20)21)14(19(12)15)11-18-8-3-2-4-9-18/h5-7H,2-4,8-11H2,1H3,(H,20,21)/p+1