XIY
Summary
Name: | 2-HYDROXYMETHYL-BENZOIMIDAZOLE |
Synonyms: | 1H-BENZIMIDAZOL-2-YLMETHANOL |
Formula: | C8 H8 N2 O |
Formal charge: | 0 |
Formula weight: | 148.162 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 1H-benzimidazol-2-ylmethanol |
OpenEye OEToolkits | 1.6.1 | 1H-benzimidazol-2-ylmethanol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OCc2nc1ccccc1n2 |
SMILES_CANONICAL | CACTVS | 3.352 | OCc1[nH]c2ccccc2n1 |
SMILES | CACTVS | 3.352 | OCc1[nH]c2ccccc2n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | c1ccc2c(c1)[nH]c(n2)CO |
SMILES | OpenEye OEToolkits | 1.6.1 | c1ccc2c(c1)[nH]c(n2)CO |
InChI | InChI | 1.03 | InChI=1S/C8H8N2O/c11-5-8-9-6-3-1-2-4-7(6)10-8/h1-4,11H,5H2,(H,9,10) |
InChIKey | InChI | 1.03 | IAJLTMBBAVVMQO-UHFFFAOYSA-N |