| SpectraBase Spectrum ID |
89hC3DlU5g9 |
| Name |
Ethyl-1-(4-(2-(2-chloroacetyl)hydrazinecarbonyl)phenyl)-5-(4-nitrophenyl)3-oxo-2,3-dihydro-1H-pyrazol-4-carboxylate |
| Alternate Name(s) |
2-[4-[[(2-chloro-1-oxoethyl)hydrazo]-oxomethyl]phenyl]-3-(4-nitrophenyl)-5-oxo-1H-pyrazole-4-carboxylic acid ethyl ester
ethyl 2-[4-[[(2-chloroacetyl)amino]carbamoyl]phenyl]-3-(4-nitrophenyl)-5-oxo-1H-pyrazole-4-carboxylate
ethyl 2-[4-[(2-chloranylethanoylamino)carbamoyl]phenyl]-3-(4-nitrophenyl)-5-oxidanylidene-1H-pyrazole-4-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H18ClN5O7 |
| InChI |
InChI=1S/C21H18ClN5O7/c1-2-34-21(31)17-18(12-3-9-15(10-4-12)27(32)33)26(25-20(17)30)14-7-5-13(6-8-14)19(29)24-23-16(28)11-22/h3-10H,2,11H2,1H3,(H,23,28)(H,24,29)(H,25,30) |
| InChIKey |
MEARSHUCHHBTBL-UHFFFAOYSA-N |
| Molecular Weight |
487.856 g/mol |
| SMILES |
N1N(c2ccc(C(NNC(=O)CCl)=O)cc2)C(=C(C(=O)OCC)C1=O)c1ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-03di-0000900000-b839e2bc77fc5f543c9d |
| Source of Spectrum |
F2-44-4632-6f |
| Wiley ID |
1705826 |
