2-azanyl-1-methyl-3-oxidanyl-2,7-dihydropurin-6-one; ethanoic acid

Systemtic Name: 2-azanyl-1-methyl-3-oxidanyl-2,7-dihydropurin-6-one; ethanoic acid Openeye Name: acetic acid; 2-amino-3-hydroxy-1-methyl-2,7-dihydropurin-6-one CAS Name: acetic acid; 2-amino-3-hydroxy-1-methyl-2,7-dihydropurin-6-one IUPAC Name: acetic acid; 2-amino-3-hydroxy-1-methyl-2,7-dihydropurin-6-one Traditional Name: acetic acid; 2-amino-3-hydroxy-1-methyl-2,7-dihydropurin-6-one Formula: C8H13N5O4 MolecularWeight: 243.21992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CN1C(N(C2=C(C1=O)NC=N2)O)N

Isomeric SMILES

CC(=O)O.CN1C(N(C2=C(C1=O)NC=N2)O)N

InChI

InChI=1S/C6H9N5O2.C2H4O2/c1-10-5(12)3-4(9-2-8-3)11(13)6(10)7;1-2(3)4/h2,6,13H,7H2,1H3,(H,8,9);1H3,(H,3,4)