zinc 3-[[9,10-bis(oxidanylidene)-4-[3-(triethylazaniumyl)propylamino]anthracen-1-yl]amino]propyl-triethyl-azanium tetrachloride

Systemtic Name: zinc 3-[[9,10-bis(oxidanylidene)-4-[3-(triethylazaniumyl)propylamino]anthracen-1-yl]amino]propyl-triethyl-azanium tetrachloride Openeye Name: zinc 3-[[9,10-dioxo-4-[3-(triethylammonio)propylamino]-1-anthryl]amino]propyl-triethyl-ammonium tetrachloride CAS Name: zinc 3-[[9,10-dioxo-4-[3-(triethylammonio)propylamino]-1-anthracenyl]amino]propyl-triethylammonium tetrachloride IUPAC Name: zinc 3-[[9,10-dioxo-4-[3-(triethylazaniumyl)propylamino]anthracen-1-yl]amino]propyl-triethylazanium tetrachloride Traditional Name: zinc 3-[[9,10-diketo-4-[3-(triethylammonio)propylamino]-1-anthryl]amino]propyl-triethyl-ammonium tetrachloride Formula: C32H50Cl4N4O2Zn MolecularWeight: 729.986

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCCNC1=C2C(=C(C=C1)NCCC[N+](CC)(CC)CC)C(=O)C3=CC=CC=C3C2=O.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]

Isomeric SMILES

CC[N+](CC)(CC)CCCNC1=C2C(=C(C=C1)NCCC[N+](CC)(CC)CC)C(=O)C3=CC=CC=C3C2=O.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]

InChI

InChI=1S/C32H48N4O2.4ClH.Zn/c1-7-35(8-2,9-3)23-15-21-33-27-19-20-28(34-22-16-24-36(10-4,11-5)12-6)30-29(27)31(37)25-17-13-14-18-26(25)32(30)38;;;;;/h13-14,17-20H,7-12,15-16,21-24H2,1-6H3;4*1H;/q;;;;;+2/p-2