SpectraBase Spectrum ID |
AETnWH2nK2D |
Name |
2-[4-(2-hydroxyethyl)-1-piperazinyl]-3,5-dinitrobenzoic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H16N4O7 |
InChI |
InChI=1S/C13H16N4O7/c18-6-5-14-1-3-15(4-2-14)12-10(13(19)20)7-9(16(21)22)8-11(12)17(23)24/h7-8,18H,1-6H2,(H,19,20) |
InChIKey |
NHUNQOYVQPNQDB-UHFFFAOYSA-N |
Molecular Weight |
340.292 g/mol |
SMILES |
OC(c1c(N2CCN(CCO)CC2)c(cc(c1)N(=O)=O)N(=O)=O)=O |
SPLASH |
splash10-0a4i-4569000000-bd81374a92a3100e1f9c |
Synonyms |
2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-3,5-dinitrobenzoate
2-[4-(2-hydroxyethyl)piperazin-1-yl]-3,5-dinitro-benzoic acid
2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3,5-dinitro-benzoate
2-[4-(2-hydroxyethyl)piperazino]-3,5-dinitro-benzoic acid |
Wiley ID |
1451403 |