4-[[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-yl)phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-yl)phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-yl)anilino]-4-oxo-butanoic acid CAS Name: 4-[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-yl)anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-yl)anilino]-4-oxobutanoic acid Traditional Name: 4-[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-yl)anilino]-4-keto-butyric acid Formula: C17H16N3O3+ MolecularWeight: 310.32724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C=C(NC2=C1)C3=CC=C(C=C3)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=[N+]2C=C(NC2=C1)C3=CC=C(C=C3)NC(=O)CCC(=O)O

InChI

InChI=1S/C17H15N3O3/c21-16(8-9-17(22)23)18-13-6-4-12(5-7-13)14-11-20-10-2-1-3-15(20)19-14/h1-7,10-11H,8-9H2,(H2,18,21,22,23)/p+1