2-azanyl-8-oxidanylidene-6-[1,2,3-tris(oxidanyl)propyl]-2,3-dihydropteridin-8-ium-4-one

Systemtic Name: 2-azanyl-8-oxidanylidene-6-[1,2,3-tris(oxidanyl)propyl]-2,3-dihydropteridin-8-ium-4-one Openeye Name: 2-amino-8-oxo-6-(1,2,3-trihydroxypropyl)-2,3-dihydropteridin-8-ium-4-one CAS Name: 2-amino-8-oxo-6-(1,2,3-trihydroxypropyl)-2,3-dihydropteridin-8-ium-4-one IUPAC Name: 2-amino-8-oxo-6-(1,2,3-trihydroxypropyl)-2,3-dihydropteridin-8-ium-4-one Traditional Name: 2-amino-8-keto-6-(1,2,3-trihydroxypropyl)-2,3-dihydropteridin-8-ium-4-one Formula: C9H12N5O5+ MolecularWeight: 270.22208

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C2C(=O)NC(N=C2[N+]1=O)N)C(C(CO)O)O

Isomeric SMILES

C1=C(N=C2C(=O)NC(N=C2[N+]1=O)N)C(C(CO)O)O

InChI

InChI=1S/C9H11N5O5/c10-9-12-7-5(8(18)13-9)11-3(1-14(7)19)6(17)4(16)2-15/h1,4,6,9,15-17H,2,10H2/p+1