P9P
Summary
Name: | 2-chloranyl-4-nitro-phenol |
Formula: | C6 H4 Cl N O3 |
Formal charge: | 0 |
Formula weight: | 173.554 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.4 | 2-chloranyl-4-nitro-phenol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C6H4ClNO3/c7-5-3-4(8(10)11)1-2-6(5)9/h1-3,9H |
InChIKey | InChI | 1.03 | BOFRXDMCQRTGII-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(cc1Cl)[N](=O)=O |
SMILES | CACTVS | 3.385 | Oc1ccc(cc1Cl)[N](=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1cc(c(cc1N(=O)=O)Cl)O |
SMILES | OpenEye OEToolkits | 2.0.4 | c1cc(c(cc1N(=O)=O)Cl)O |