HM0
Summary
Name: | 1-cyclobutylimidazole-2-carboxylic acid |
Formula: | C8 H10 N2 O2 |
Formal charge: | 0 |
Formula weight: | 166.177 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 1-cyclobutylimidazole-2-carboxylic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C8H10N2O2/c11-8(12)7-9-4-5-10(7)6-2-1-3-6/h4-6H,1-3H2,(H,11,12) |
InChIKey | InChI | 1.03 | NZCLFPVXVQMPNV-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1nccn1C2CCC2 |
SMILES | CACTVS | 3.385 | OC(=O)c1nccn1C2CCC2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cn(c(n1)C(=O)O)C2CCC2 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cn(c(n1)C(=O)O)C2CCC2 |