6-(1-oxidanidylpyridin-1-ium-4-yl)-3-(3-oxidanylpropyl)-1H-imidazo[4,5-b]pyridin-2-one

Systemtic Name: 6-(1-oxidanidylpyridin-1-ium-4-yl)-3-(3-oxidanylpropyl)-1H-imidazo[4,5-b]pyridin-2-one Openeye Name: 3-(3-hydroxypropyl)-6-(1-oxidopyridin-1-ium-4-yl)-1H-imidazo[4,5-b]pyridin-2-one CAS Name: 3-(3-hydroxypropyl)-6-(1-oxido-4-pyridin-1-iumyl)-1H-imidazo[4,5-b]pyridin-2-one IUPAC Name: 3-(3-hydroxypropyl)-6-(1-oxidopyridin-1-ium-4-yl)-1H-imidazo[4,5-b]pyridin-2-one Traditional Name: 3-(3-hydroxypropyl)-6-(1-oxidopyridin-1-ium-4-yl)-1H-imidazo[4,5-b]pyridin-2-one Formula: C14H14N4O3 MolecularWeight: 286.28596

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CC=C1C2=CC3=C(N=C2)N(C(=O)N3)CCCO)[O-]

Isomeric SMILES

C1=C[N+](=CC=C1C2=CC3=C(N=C2)N(C(=O)N3)CCCO)[O-]

InChI

InChI=1S/C14H14N4O3/c19-7-1-4-18-13-12(16-14(18)20)8-11(9-15-13)10-2-5-17(21)6-3-10/h2-3,5-6,8-9,19H,1,4,7H2,(H,16,20)