98K
Summary
Name: | 2-chloranyl-1~{H}-benzimidazole |
Formula: | C7 H5 Cl N2 |
Formal charge: | 0 |
Formula weight: | 152.581 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 2-chloranyl-1~{H}-benzimidazole |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C7H5ClN2/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H,9,10) |
InChIKey | InChI | 1.03 | AYPSHJCKSDNETA-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Clc1[nH]c2ccccc2n1 |
SMILES | CACTVS | 3.385 | Clc1[nH]c2ccccc2n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)[nH]c(n2)Cl |
SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)[nH]c(n2)Cl |