ZPO
Summary
Name: | pyrazolidine-1-carboxylic acid |
Formula: | C4 H8 N2 O2 |
Formal charge: | 0 |
Formula weight: | 116.119 Da |
Component type: | peptide-like |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | pyrazolidine-1-carboxylic acid |
OpenEye OEToolkits | 2.0.6 | pyrazolidine-1-carboxylic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N1CCCN1C(O)=O |
InChI | InChI | 1.03 | InChI=1S/C4H8N2O2/c7-4(8)6-3-1-2-5-6/h5H,1-3H2,(H,7,8) |
InChIKey | InChI | 1.03 | FNNIAKKPBXJGNJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)N1CCCN1 |
SMILES | CACTVS | 3.385 | OC(=O)N1CCCN1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C1CNN(C1)C(=O)O |
SMILES | OpenEye OEToolkits | 2.0.6 | C1CNN(C1)C(=O)O |