N2-[4-[3-[3-[4-[[4,6-bis(octylamino)-1,3,5-triazin-2-yl]amino]phenoxy]propoxy]propoxy]phenyl]-N4,N6-dioctyl-1,3,5-triazine-2,4,6-triamine

Systemtic Name: N2-[4-[3-[3-[4-[[4,6-bis(octylamino)-1,3,5-triazin-2-yl]amino]phenoxy]propoxy]propoxy]phenyl]-N4,N6-dioctyl-1,3,5-triazine-2,4,6-triamine Openeye Name: N2-[4-[3-[3-[4-[[4,6-bis(octylamino)-1,3,5-triazin-2-yl]amino]phenoxy]propoxy]propoxy]phenyl]-N4,N6-dioctyl-1,3,5-triazine-2,4,6-triamine CAS Name: N2-[4-[3-[3-[4-[[4,6-bis(octylamino)-1,3,5-triazin-2-yl]amino]phenoxy]propoxy]propoxy]phenyl]-N4,N6-dioctyl-1,3,5-triazine-2,4,6-triamine IUPAC Name: 2-N-[4-[3-[3-[4-[[4,6-bis(octylamino)-1,3,5-triazin-2-yl]amino]phenoxy]propoxy]propoxy]phenyl]-4-N,6-N-dioctyl-1,3,5-triazine-2,4,6-triamine Traditional Name: [4,6-bis(octylamino)-s-triazin-2-yl]-[4-[3-[3-[4-[[4,6-bis(octylamino)-s-triazin-2-yl]amino]phenoxy]propoxy]propoxy]phenyl]amine Formula: C56H94N12O3 MolecularWeight: 983.42416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=NC(=NC(=N1)NC2=CC=C(C=C2)OCCCOCCCOC3=CC=C(C=C3)NC4=NC(=NC(=N4)NCCCCCCCC)NCCCCCCCC)NCCCCCCCC

Isomeric SMILES

CCCCCCCCNC1=NC(=NC(=N1)NC2=CC=C(C=C2)OCCCOCCCOC3=CC=C(C=C3)NC4=NC(=NC(=N4)NCCCCCCCC)NCCCCCCCC)NCCCCCCCC

InChI

InChI=1S/C56H94N12O3/c1-5-9-13-17-21-25-39-57-51-63-52(58-40-26-22-18-14-10-6-2)66-55(65-51)61-47-31-35-49(36-32-47)70-45-29-43-69-44-30-46-71-50-37-33-48(34-38-50)62-56-67-53(59-41-27-23-19-15-11-7-3)64-54(68-56)60-42-28-24-20-16-12-8-4/h31-38H,5-30,39-46H2,1-4H3,(H3,57,58,61,63,65,66)(H3,59,60,62,64,67,68)