2-[[9,10-bis(oxidanylidene)-4-[2-(trimethylazaniumyl)ethylamino]anthracen-1-yl]amino]ethyl-trimethyl-azanium diiodide

Systemtic Name: 2-[[9,10-bis(oxidanylidene)-4-[2-(trimethylazaniumyl)ethylamino]anthracen-1-yl]amino]ethyl-trimethyl-azanium diiodide Openeye Name: 2-[[9,10-dioxo-4-[2-(trimethylammonio)ethylamino]-1-anthryl]amino]ethyl-trimethyl-ammonium diiodide CAS Name: 2-[[9,10-dioxo-4-[2-(trimethylammonio)ethylamino]-1-anthracenyl]amino]ethyl-trimethylammonium diiodide IUPAC Name: 2-[[9,10-dioxo-4-[2-(trimethylazaniumyl)ethylamino]anthracen-1-yl]amino]ethyl-trimethylazanium diiodide Traditional Name: 2-[[9,10-diketo-4-[2-(trimethylammonio)ethylamino]-1-anthryl]amino]ethyl-trimethyl-ammonium diiodide Formula: C24H34I2N4O2 MolecularWeight: 664.3613

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCNC1=C2C(=C(C=C1)NCC[N+](C)(C)C)C(=O)C3=CC=CC=C3C2=O.[I-].[I-]

Isomeric SMILES

C[N+](C)(C)CCNC1=C2C(=C(C=C1)NCC[N+](C)(C)C)C(=O)C3=CC=CC=C3C2=O.[I-].[I-]

InChI

InChI=1S/C24H32N4O2.2HI/c1-27(2,3)15-13-25-19-11-12-20(26-14-16-28(4,5)6)22-21(19)23(29)17-9-7-8-10-18(17)24(22)30;;/h7-12H,13-16H2,1-6H3;2*1H