Benzoic acid, 4-nitro-, ethyl ester (Predicted)
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Basic Info
| FADB-China ID | P2439 |
| Molecular Name | Benzoic acid, 4-nitro-, ethyl ester |
| Basis for prediction | Benzocaine |
| Similarity (based on Tanimoto coefficient and ECFP6 fingerprint) | 0.7229 |
| Similarity (based on Tanimoto coefficient and Daylight fingerprint) | 0.7598 |
| Similarity (based on MCS) | 0.8571 |
| 2D Structure | |
| SMILES | CCOC(=O)c1ccc([N+](=O)[O-])cc1 |
| CFM-ID 3.0 (Copy SMILES to the website's input box) | URL Link |
| Update Date | Jul 30, 2019 14:16 |
References
| Title | Data Sources |
|---|---|
| Source | HPV EPA Chemicals |
| PubChem Link | URL Link |