Mol:
180749-08-0.mol by:chem960.com
ChemDraw08031019472D
…………
.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9235 4.4108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 3.1400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9235 1.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 7 1 0 0 0 0
7 2 2 0 0 0 0
4 8 2 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 3 2 0 0 0 0
M END
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1H-吡唑并[3,4-d]嘧啶-4-醇 InChIKey: OFCNXPDARWKPPY-UHFFFAOYSA-N
1H-吡唑并[3,4-d]嘧啶-4-醇 Inchi: InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)
1H-吡唑并[3,4-d]嘧啶-4-醇 SMILES: OC1=NC=NC2=NNC=C12