| SpectraBase Spectrum ID |
AiyNf31zVMM |
| Name |
25,26,27,28-Tetraacetoxy-5,17-bis(ethoxycarbonyl)-11,23-dinitrocalix[4]arene |
| Alternate Name(s) |
5,11-diethyl 25,26,27,28-tetrakis(acetyloxy)-17,23-dinitropentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(24),3,5,7(28),9,11,13(27),15,17,19(26),21(25),22-dodecaene-5,11-dicarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C42H38N2O16 |
| InChI |
InChI=1S/C42H38N2O16/c1-7-55-41(49)33-13-25-9-26-14-34(42(50)56-8-2)16-28(38(26)58-22(4)46)11-30-18-36(44(53)54)20-32(40(30)60-24(6)48)12-31-19-35(43(51)52)17-29(39(31)59-23(5)47)10-27(15-33)37(25)57-21(3)45/h13-20H,7-12H2,1-6H3 |
| InChIKey |
KWCWXHFAVRTDOY-UHFFFAOYSA-N |
| Molecular Weight |
826.764 g/mol |
| SMILES |
c1(N(=O)=O)cc2Cc3c(c(Cc4cc(cc(Cc5c(c(Cc(c1)c2OC(=O)C)cc(C(=O)OCC)c5)OC(=O)C)c4OC(=O)C)C(=O)OCC)cc(N(=O)=O)c3)OC(=O)C |
| SPLASH |
splash10-03di-0000009000-09faab12fec316daba19 |
| Source of Spectrum |
J-56-3375-19 |
| Wiley ID |
1417494 |
![25,26,27,28-Tetraacetoxy-5,17-bis(ethoxycarbonyl)-11,23-dinitrocalix[4]arene](/api/spectrum/AiyNf31zVMM/structure.png?h=300&w=458 "25,26,27,28-Tetraacetoxy-5,17-bis(ethoxycarbonyl)-11,23-dinitrocalix[4]arene")
