PZO
Summary
Name: | PYRAZOLE |
Formula: | C3 H4 N2 |
Formal charge: | 0 |
Formula weight: | 68.077 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 1H-pyrazole |
OpenEye OEToolkits | 1.5.0 | 1H-pyrazole |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | n1cccn1 |
SMILES_CANONICAL | CACTVS | 3.341 | [nH]1cccn1 |
SMILES | CACTVS | 3.341 | [nH]1cccn1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1c[nH]nc1 |
SMILES | OpenEye OEToolkits | 1.5.0 | c1c[nH]nc1 |
InChI | InChI | 1.03 | InChI=1S/C3H4N2/c1-2-4-5-3-1/h1-3H,(H,4,5) |
InChIKey | InChI | 1.03 | WTKZEGDFNFYCGP-UHFFFAOYSA-N |