1-[3-(4-azanylimidazo[4,5-c]pyridin-1-yl)-2-oxidanyl-propyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[3-(4-azanylimidazo[4,5-c]pyridin-1-yl)-2-oxidanyl-propyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-2-hydroxy-propyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[3-(4-amino-1-imidazo[4,5-c]pyridinyl)-2-hydroxypropyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-2-hydroxypropyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-2-hydroxy-propyl]pyridin-1-ium-3-carboxamide Formula: C15H17N6O2+ MolecularWeight: 313.33448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC(CN2C=NC3=C2C=CN=C3N)O)C(=O)N

Isomeric SMILES

C1=CC(=C[N+](=C1)CC(CN2C=NC3=C2C=CN=C3N)O)C(=O)N

InChI

InChI=1S/C15H16N6O2/c16-14-13-12(3-4-18-14)21(9-19-13)8-11(22)7-20-5-1-2-10(6-20)15(17)23/h1-6,9,11,22H,7-8H2,(H3-,16,17,18,23)/p+1