| SpectraBase Spectrum ID |
1O5NlqjHEOa |
| Name |
Benzoic acid, 4-chloro-5-cyano-2-hydroxy-3-nitro-, ethyl ester |
| Alternate Name(s) |
6-Chloro-3-nitro-2-hydroxy-5-cyano-4-ethoxycarbonyl-benzene
Ethyl 3-chloro-2-cyano-5-hydroxy-6-nitrobenzoate |
| CAS Registry Number |
105290-68-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H7ClN2O5 |
| InChI |
InChI=1S/C10H7ClN2O5/c1-2-18-10(15)8-5(4-12)6(11)3-7(14)9(8)13(16)17/h3,14H,2H2,1H3 |
| InChIKey |
UOQJMUSGRGOIPI-UHFFFAOYSA-N |
| Molecular Weight |
270.628 g/mol |
| SMILES |
Oc1c(c(c(c(c1)Cl)C#N)C(=O)OCC)N(=O)=O |
| SPLASH |
splash10-01c3-0490000000-d442a5ae503ab90fc2d8 |
| Source of Spectrum |
AH-117-401-5 |
| Wiley ID |
1273621 |
