bis(chloranyl)zinc; [7-(dimethylamino)-4-nitro-phenothiazin-3-ylidene]-dimethyl-azanium; dichloride

Systemtic Name: bis(chloranyl)zinc; [7-(dimethylamino)-4-nitro-phenothiazin-3-ylidene]-dimethyl-azanium; dichloride Openeye Name: dichlorozinc; [7-(dimethylamino)-4-nitro-phenothiazin-3-ylidene]-dimethyl-ammonium; dichloride CAS Name: dichlorozinc; [7-(dimethylamino)-4-nitro-3-phenothiazinylidene]-dimethylammonium; dichloride IUPAC Name: dichlorozinc; [7-(dimethylamino)-4-nitrophenothiazin-3-ylidene]-dimethylazanium; dichloride Traditional Name: dichlorozinc; [7-(dimethylamino)-4-nitro-phenothiazin-3-ylidene]-dimethyl-ammonium; dichloride Formula: C32H34Cl4N8O4S2Zn MolecularWeight: 866.01456

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C(=C3S2)[N+](=O)[O-].CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C(=C3S2)[N+](=O)[O-].[Cl-].[Cl-].Cl[Zn]Cl

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C(=C3S2)[N+](=O)[O-].CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C(=C3S2)[N+](=O)[O-].[Cl-].[Cl-].Cl[Zn]Cl

InChI

InChI=1S/2C16H17N4O2S.4ClH.Zn/c2*1-18(2)10-5-6-11-14(9-10)23-16-12(17-11)7-8-13(19(3)4)15(16)20(21)22;;;;;/h2*5-9H,1-4H3;4*1H;/q2*+1;;;;;+2/p-4