4-methyl-3-[2-(5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl)ethanoylamino]benzoate

Systemtic Name: 4-methyl-3-[2-(5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl)ethanoylamino]benzoate Openeye Name: 4-methyl-3-[[2-(5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl)acetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-(5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl)-1-oxoethyl]amino]benzoate IUPAC Name: 4-methyl-3-[[2-(5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl)acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-(5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl)acetyl]amino]benzoate Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)CC2=C[N+]3=C(C=CC=C3N2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)CC2=C[N+]3=C(C=CC=C3N2)C

InChI

InChI=1S/C18H17N3O3/c1-11-6-7-13(18(23)24)8-15(11)20-17(22)9-14-10-21-12(2)4-3-5-16(21)19-14/h3-8,10H,9H2,1-2H3,(H2,20,22,23,24)