化学式

CAS号

IUPAC Name

16,41-二氯-2,15,28,41,53,54,55,56-octazatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1,3(56),4,6,8,10,12,14,17,19,21,23,25,27(55),28,30,32,34,36,38,40(54),42(53),43,45,47,49,51-heptacosaene 16,41-dichloro-2,15,28,41,53,54,55,56-octazatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1,3(56),4,6,8,10,12,14,17,19,21,23,25,27(55),28,30,32,34,36,38,40(54),42(53),43,45,47,49,51-heptacosaene

InChI

InChI=1S/C48H24Cl2N8/c49-48-40-24-32-16-8-7-15-31(32)23-39(40)45(57-48)53-43-36-20-28-12-4-6-14-30(28)22-38(36)47(55-43)58(50)46-37-21-29-13-5-3-11-27(29)19-35(37)42(54-46)51-41-33-17-25-9-1-2-10-26(25)18-34(33)44(52-41)56-48/h1-24H

InChI Key

PFEXZWSHPCUYKR-UHFFFAOYSA-N

Canonical SMILES

C1=CC=C2C=C3C(=CC2=C1)C4=NC3=NC5(C6=CC7=CC=CC=C7C=C6C(=N5)N=C8C9=CC1=CC=CC=C1C=C9C(=N8)N(C1=NC(=N4)C2=CC3=CC=CC=C3C=C21)Cl)Cl

别名