SpectraBase Spectrum ID |
1djjx2AxvM |
Name |
{{6-[(3',5'-Dinitrobenzoylamino)]methyl]cyclohex-3-en-1-yl}methyl 3,5-dinitrobenzoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H19N5O11 |
InChI |
InChI=1S/C22H19N5O11/c28-21(15-5-17(24(30)31)9-18(6-15)25(32)33)23-11-13-3-1-2-4-14(13)12-38-22(29)16-7-19(26(34)35)10-20(8-16)27(36)37/h1-2,5-10,13-14H,3-4,11-12H2,(H,23,28) |
InChIKey |
SWIFKLOSICMTGT-UHFFFAOYSA-N |
Molecular Weight |
529.418 g/mol |
SMILES |
N(C(c1cc(N(=O)=O)cc(N(=O)=O)c1)=O)CC1C(COC(c2cc(N(=O)=O)cc(N(=O)=O)c2)=O)CC=CC1 |
SPLASH |
splash10-002f-9200000000-350d5650e9a0c507a9a8 |
Source of Spectrum |
H-79-891-0 |
Synonyms |
(6-{[(3,5-dinitrobenzoyl)amino]methyl}-3-cyclohexen-1-yl)methyl 3,5-dinitrobenzoate |
Wiley ID |
1403182 |