N1,N4-bis[4-[N,N'-diethyl-N-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoyl]carbamimidoyl]phenyl]benzene-1,4-dicarboxamide

Systemtic Name: N1,N4-bis[4-[N,N'-diethyl-N-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoyl]carbamimidoyl]phenyl]benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[4-[N,N'-diethyl-N-(2,2,3,3,4,4,4-heptafluorobutanoyl)carbamimidoyl]phenyl]terephthalamide CAS Name: N1,N4-bis[4-[[ethyl-(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]-ethyliminomethyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[4-[N,N'-diethyl-N-(2,2,3,3,4,4,4-heptafluorobutanoyl)carbamimidoyl]phenyl]benzene-1,4-dicarboxamide Traditional Name: N,N'-bis[4-[N,N'-diethyl-N-(2,2,3,3,4,4,4-heptafluorobutanoyl)amidino]phenyl]terephthalamide Formula: C38H34F14N6O4 MolecularWeight: 904.692005

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NCC)N(CC)C(=O)C(C(C(F)(F)F)(F)F)(F)F)N(CC)C(=O)C(C(C(F)(F)F)(F)F)(F)F

Isomeric SMILES

CCN=C(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NCC)N(CC)C(=O)C(C(C(F)(F)F)(F)F)(F)F)N(CC)C(=O)C(C(C(F)(F)F)(F)F)(F)F

InChI

InChI=1S/C38H34F14N6O4/c1-5-53-27(57(7-3)31(61)33(39,40)35(43,44)37(47,48)49)21-13-17-25(18-14-21)55-29(59)23-9-11-24(12-10-23)30(60)56-26-19-15-22(16-20-26)28(54-6-2)58(8-4)32(62)34(41,42)36(45,46)38(50,51)52/h9-20H,5-8H2,1-4H3,(H,55,59)(H,56,60)