化学式

CAS号

IUPAC Name

5,12,18,25,31,38,44,51-octabutoxy-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( 5,12,18,25,31,38,44,51-octabutoxy-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/C80H88Cl2N8O8/c1-9-17-41-91-65-49-33-25-26-34-50(49)66(92-42-18-10-2)58-57(65)73-83-74-59-61(69(95-45-21-13-5)53-37-29-27-35-51(53)67(59)93-43-19-11-3)78(86-74)90(82)79-62-60(68(94-44-20-12-4)52-36-28-30-38-54(52)70(62)96-46-22-14-6)75(87-79)85-77-63-64(80(81,89-77)88-76(58)84-73)72(98-48-24-16-8)56-40-32-31-39-55(56)71(63)97-47-23-15-7/h25-40H,9-24,41-48H2,1-8H3

InChI Key

OEKZYOVVHQTUTC-UHFFFAOYSA-N

Canonical SMILES

CCCCOC1=C2C(=C(C3=CC=CC=C31)OCCCC)C4=NC5(C6=C(C7=CC=CC=C7C(=C6C(=N5)N=C8C9=C(C1=CC=CC=C1C(=C9C(=N8)N(C1=NC(=NC2=N4)C2=C(C3=CC=CC=C3C(=C21)OCCCC)OCCCC)Cl)OCCCC)OCCCC)OCCCC)OCCCC)Cl

别名