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2-[2-[carboxymethyl-[2-oxidanylidene-2-[7-[[2-(trifluoromethyloxy)acridin-9-yl]amino]heptylamino]ethyl]amino]ethyl-[2-oxidanylidene-2-[7-[[2-(trifluoromethyloxy)acridin-9-yl]amino]heptylamino]ethyl]amino]ethanoic acid

2-[2-[carboxymethyl-[2-oxidanylidene-2-[7-[[2-(trifluoromethyloxy)acridin-9-yl]amino]heptylamino]ethyl]amino]ethyl-[2-oxidanylidene-2-[7-[[2-(trifluoromethyloxy)acridin-9-yl]amino]heptylamino]ethyl]amino]ethanoic acid

Systemtic Name:2-[2-[carboxymethyl-[2-oxidanylidene-2-[7-[[2-(trifluoromethyloxy)acridin-9-yl]amino]heptylamino]ethyl]amino]ethyl-[2-oxidanylidene-2-[7-[[2-(trifluoromethyloxy)acridin-9-yl]amino]heptylamino]ethyl]amino]ethanoic acid
Openeye Name:2-[2-[carboxymethyl-[2-oxo-2-[7-[[2-(trifluoromethoxy)acridin-9-yl]amino]heptylamino]ethyl]amino]ethyl-[2-oxo-2-[7-[[2-(trifluoromethoxy)acridin-9-yl]amino]heptylamino]ethyl]amino]acetic acid
CAS Name:2-[2-[carboxymethyl-[2-oxo-2-[7-[[2-(trifluoromethoxy)-9-acridinyl]amino]heptylamino]ethyl]amino]ethyl-[2-oxo-2-[7-[[2-(trifluoromethoxy)-9-acridinyl]amino]heptylamino]ethyl]amino]acetic acid
IUPAC Name:2-[2-[carboxymethyl-[2-oxo-2-[7-[[2-(trifluoromethoxy)acridin-9-yl]amino]heptylamino]ethyl]amino]ethyl-[2-oxo-2-[7-[[2-(trifluoromethoxy)acridin-9-yl]amino]heptylamino]ethyl]amino]acetic acid
Traditional Name:2-[2-[carboxymethyl-[2-keto-2-[7-[[2-(trifluoromethoxy)acridin-9-yl]amino]heptylamino]ethyl]amino]ethyl-[2-keto-2-[7-[[2-(trifluoromethoxy)acridin-9-yl]amino]heptylamino]ethyl]amino]acetic acid
Formula: C52H60F6N8O8
MolecularWeight: 1039.072019
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=C(C=CC3=N2)OC(F)(F)F)NCCCCCCCNC(=O)CN(CCN(CC(=O)NCCCCCCCNC4=C5C=C(C=CC5=NC6=CC=CC=C64)OC(F)(F)F)CC(=O)O)CC(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=C(C=CC3=N2)OC(F)(F)F)NCCCCCCCNC(=O)CN(CCN(CC(=O)NCCCCCCCNC4=C5C=C(C=CC5=NC6=CC=CC=C64)OC(F)(F)F)CC(=O)O)CC(=O)O


InChI

InChI=1S/C52H60F6N8O8/c53-51(54,55)73-35-19-21-43-39(29-35)49(37-15-7-9-17-41(37)63-43)61-25-13-5-1-3-11-23-59-45(67)31-65(33-47(69)70)27-28-66(34-48(71)72)32-46(68)60-24-12-4-2-6-14-26-62-50-38-16-8-10-18-42(38)64-44-22-20-36(30-40(44)50)74-52(56,57)58/h7-10,15-22,29-30H,1-6,11-14,23-28,31-34H2,(H,59,67)(H,60,68)(H,61,63)(H,62,64)(H,69,70)(H,71,72)


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