bis(chloranyl)iron(1+); [6-(diethylamino)xanthen-3-ylidene]-diethyl-azanium

Systemtic Name: bis(chloranyl)iron(1+); [6-(diethylamino)xanthen-3-ylidene]-diethyl-azanium Openeye Name: dichloroiron(1+); [6-(diethylamino)xanthen-3-ylidene]-diethyl-ammonium CAS Name: dichloroiron(1+); [6-(diethylamino)-3-xanthenylidene]-diethylammonium IUPAC Name: dichloroiron(1+); [6-(diethylamino)xanthen-3-ylidene]-diethylazanium Traditional Name: dichloroiron(1+); [6-(diethylamino)xanthen-3-ylidene]-diethyl-ammonium Formula: C21H27Cl2FeN2O+2 MolecularWeight: 450.20288

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C=C3C=CC(=[N+](CC)CC)C=C3O2.Cl[Fe+]Cl

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C=C3C=CC(=[N+](CC)CC)C=C3O2.Cl[Fe+]Cl

InChI

InChI=1S/C21H27N2O.2ClH.Fe/c1-5-22(6-2)18-11-9-16-13-17-10-12-19(23(7-3)8-4)15-21(17)24-20(16)14-18;;;/h9-15H,5-8H2,1-4H3;2*1H;/q+1;;;+3/p-2