F0M
Summary
Name: | 2-methoxy-4-nitrophenol |
Synonyms: | 4-Nitroguaiacol |
Formula: | C7 H7 N O4 |
Formal charge: | 0 |
Formula weight: | 169.135 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 2-methoxy-4-nitrophenol |
OpenEye OEToolkits | 2.0.6 | 2-methoxy-4-nitro-phenol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | COc1c(O)ccc(c1)N(=O)=O |
InChI | InChI | 1.03 | InChI=1S/C7H7NO4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3 |
InChIKey | InChI | 1.03 | IZLVFLOBTPURLP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(ccc1O)[N](=O)=O |
SMILES | CACTVS | 3.385 | COc1cc(ccc1O)[N](=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1cc(ccc1O)N(=O)=O |
SMILES | OpenEye OEToolkits | 2.0.6 | COc1cc(ccc1O)N(=O)=O |