| SpectraBase Spectrum ID |
3luq6XOsAi |
| Name |
5,20-bis(Chloroacetyl)-5,12,13,20-tetraaza[5.2.5.1.](1,3)(1,3)(1,4)(1,4)-cyclophan-12-ene |
| Alternate Name(s) |
12,24-bis(chloroacetyl)-12,18,19,24-tetraazapentacyclo[27.2.2.2(20,23).1(3,7).1(13,17)]heptatriaconta-1(31),3(37),4,6,13(36),14,16,18,20,22,29,32,34-tridecaene |
| CAS Registry Number |
140661-63-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C37H38Cl2N4O2 |
| InChI |
InChI=1S/C37H38Cl2N4O2/c38-26-36(44)42-21-3-1-7-28-13-15-30(16-14-28)24-31-10-5-9-29(23-31)8-2-4-22-43(37(45)27-39)35-12-6-11-33(25-35)41-40-32-17-19-34(42)20-18-32/h5-6,9-20,23,25H,1-4,7-8,21-22,24,26-27H2/b41-40+ |
| InChIKey |
RQDGPNKDMIRWRG-CDJCAARLSA-N |
| Molecular Weight |
641.643 g/mol |
| SMILES |
c12N(CCCCc3cc(Cc4ccc(CCCCN(c5ccc(\N=N\c(c2)ccc1)cc5)C(=O)CCl)cc4)ccc3)C(=O)CCl |
| SPLASH |
splash10-0006-0400009000-6322bbe5fdfdad99e2b5 |
| Source of Spectrum |
K-125-1682-9 |
| Wiley ID |
1412640 |
(1,3)(1,4)(1,4)-cyclophan-12-ene](/api/spectrum/3luq6XOsAi/structure.png?h=300&w=458 "5,20-bis(Chloroacetyl)-5,12,13,20-tetraaza[5.2.5.1.](1,3)(1,3)(1,4)(1,4)-cyclophan-12-ene")
