6-[dimethyl-[3-[(3E)-1-oxidanylidene-3-(phenylmethylidene)isoindol-2-yl]propyl]azaniumyl]hexyl-dimethyl-[3-[(3E)-1-oxidanylidene-3-(phenylmethylidene)isoindol-2-yl]propyl]azanium

Systemtic Name: 6-[dimethyl-[3-[(3E)-1-oxidanylidene-3-(phenylmethylidene)isoindol-2-yl]propyl]azaniumyl]hexyl-dimethyl-[3-[(3E)-1-oxidanylidene-3-(phenylmethylidene)isoindol-2-yl]propyl]azanium Openeye Name: 3-[(1E)-1-benzylidene-3-oxo-isoindolin-2-yl]propyl-[6-[3-[(1E)-1-benzylidene-3-oxo-isoindolin-2-yl]propyl-dimethyl-ammonio]hexyl]-dimethyl-ammonium CAS Name: 6-[dimethyl-[3-[(3E)-1-oxo-3-(phenylmethylene)-2-isoindolyl]propyl]ammonio]hexyl-dimethyl-[3-[(3E)-1-oxo-3-(phenylmethylene)-2-isoindolyl]propyl]ammonium IUPAC Name: 3-[(1E)-1-benzylidene-3-oxoisoindol-2-yl]propyl-[6-[3-[(1E)-1-benzylidene-3-oxoisoindol-2-yl]propyl-dimethylazaniumyl]hexyl]-dimethylazanium Traditional Name: 3-[(1E)-1-benzal-3-keto-isoindolin-2-yl]propyl-[6-[3-[(1E)-1-benzal-3-keto-isoindolin-2-yl]propyl-dimethyl-ammonio]hexyl]-dimethyl-ammonium Formula: C46H56N4O2+2 MolecularWeight: 696.96244

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCCCC[N+](C)(C)CCCN1C(=CC2=CC=CC=C2)C3=CC=CC=C3C1=O)CCCN4C(=CC5=CC=CC=C5)C6=CC=CC=C6C4=O

Isomeric SMILES

C[N+](CCCN\1C(=O)C2=CC=CC=C2/C1=C\C3=CC=CC=C3)(CCCCCC[N+](CCCN\4C(=O)C5=CC=CC=C5/C4=C\C6=CC=CC=C6)(C)C)C

InChI

InChI=1S/C46H56N4O2/c1-49(2,33-19-29-47-43(35-37-21-9-7-10-22-37)39-25-13-15-27-41(39)45(47)51)31-17-5-6-18-32-50(3,4)34-20-30-48-44(36-38-23-11-8-12-24-38)40-26-14-16-28-42(40)46(48)52/h7-16,21-28,35-36H,5-6,17-20,29-34H2,1-4H3/q+2/b43-35+,44-36+