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2-azanyl-9-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-3H-purin-6-one; 1-oxidanylurea

2-azanyl-9-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-3H-purin-6-one; 1-oxidanylurea

Systemtic Name:2-azanyl-9-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-3H-purin-6-one; 1-oxidanylurea
Openeye Name:2-amino-9-[[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl]-3H-purin-6-one; hydroxyurea
CAS Name:2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-3H-purin-6-one; hydroxyurea
IUPAC Name:2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-3H-purin-6-one; hydroxyurea
Traditional Name:2-amino-9-[(2-hydroxy-1-methylol-ethoxy)methyl]-3H-purin-6-one; hydroxyurea
Formula: C10H17N7O6
MolecularWeight: 331.28528
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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1COC(CO)CO)NC(=NC2=O)N.C(=O)(N)NO


Isomeric SMILES

C1=NC2=C(N1COC(CO)CO)NC(=NC2=O)N.C(=O)(N)NO


InChI

InChI=1S/C9H13N5O4.CH4N2O2/c10-9-12-7-6(8(17)13-9)11-3-14(7)4-18-5(1-15)2-16;2-1(4)3-5/h3,5,15-16H,1-2,4H2,(H3,10,12,13,17);5H,(H3,2,3,4)


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