zinc [7-(diethylamino)phenothiazin-3-ylidene]-diethyl-azanium chloride

Systemtic Name: zinc [7-(diethylamino)phenothiazin-3-ylidene]-diethyl-azanium chloride Openeye Name: zinc [7-(diethylamino)phenothiazin-3-ylidene]-diethyl-ammonium chloride CAS Name: zinc [7-(diethylamino)-3-phenothiazinylidene]-diethylammonium chloride IUPAC Name: zinc [7-(diethylamino)phenothiazin-3-ylidene]-diethylazanium chloride Traditional Name: zinc [7-(diethylamino)phenothiazin-3-ylidene]-diethyl-ammonium chloride Formula: C20H26ClN3SZn+2 MolecularWeight: 441.36754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3S2.[Cl-].[Zn+2]

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3S2.[Cl-].[Zn+2]

InChI

InChI=1S/C20H26N3S.ClH.Zn/c1-5-22(6-2)15-9-11-17-19(13-15)24-20-14-16(23(7-3)8-4)10-12-18(20)21-17;;/h9-14H,5-8H2,1-4H3;1H;/q+1;;+2/p-1