6E3
Summary
Name: | 2,3,5,6-tetramethyl-1H,7H-pyrazolo[1,2-a]pyrazole-1,7-dione |
Formula: | C10 H12 N2 O2 |
Formal charge: | 0 |
Formula weight: | 192.214 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 2,3,5,6-tetramethyl-1H,7H-pyrazolo[1,2-a]pyrazole-1,7-dione |
OpenEye OEToolkits | 2.0.4 | 1,2,6,7-tetramethylpyrazolo[1,2-a]pyrazole-3,5-dione |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1C(=C(C)N2N1C(C(C)=C2C)=O)C |
InChI | InChI | 1.03 | InChI=1S/C10H12N2O2/c1-5-7(3)11-8(4)6(2)10(14)12(11)9(5)13/h1-4H3 |
InChIKey | InChI | 1.03 | VWKNUUOGGLNRNZ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC1=C(C)C(=O)N2N1C(=C(C)C2=O)C |
SMILES | CACTVS | 3.385 | CC1=C(C)C(=O)N2N1C(=C(C)C2=O)C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | CC1=C(N2C(=C(C(=O)N2C1=O)C)C)C |
SMILES | OpenEye OEToolkits | 2.0.4 | CC1=C(N2C(=C(C(=O)N2C1=O)C)C)C |