8EU
Summary
Name: | ethyl-[(4-nitrophenyl)methoxy]phosphinic acid |
Formula: | C9 H12 N O5 P |
Formal charge: | 0 |
Formula weight: | 245.169 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | ethyl-[(4-nitrophenyl)methoxy]phosphinic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C9H12NO5P/c1-2-16(13,14)15-7-8-3-5-9(6-4-8)10(11)12/h3-6H,2,7H2,1H3,(H,13,14) |
InChIKey | InChI | 1.03 | JKNVUUFWZPUKAB-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC[P](O)(=O)OCc1ccc(cc1)[N+]([O-])=O |
SMILES | CACTVS | 3.385 | CC[P](O)(=O)OCc1ccc(cc1)[N+]([O-])=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCP(=O)(O)OCc1ccc(cc1)[N+](=O)[O-] |
SMILES | OpenEye OEToolkits | 2.0.6 | CCP(=O)(O)OCc1ccc(cc1)[N+](=O)[O-] |