2-[6-[methyl-(phenylmethyl)amino]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]ethanoate

Systemtic Name: 2-[6-[methyl-(phenylmethyl)amino]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]ethanoate Openeye Name: 2-[6-[benzyl(methyl)amino]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetate CAS Name: 2-[6-[methyl-(phenylmethyl)amino]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetate IUPAC Name: 2-[6-[benzyl(methyl)amino]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetate Traditional Name: 2-[6-[benzyl(methyl)amino]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetate Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=C[N+]3=C(C=C2)NC(=C3)CC(=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=C[N+]3=C(C=C2)NC(=C3)CC(=O)[O-]

InChI

InChI=1S/C17H17N3O2/c1-19(10-13-5-3-2-4-6-13)15-7-8-16-18-14(9-17(21)22)11-20(16)12-15/h2-8,11-12H,9-10H2,1H3,(H,21,22)