[9-(4-aminophenyl)-6-(diethylamino)xanthen-3-ylidene]-diethyl-azanium chloride

Systemtic Name: [9-(4-aminophenyl)-6-(diethylamino)xanthen-3-ylidene]-diethyl-azanium chloride Openeye Name: [9-(4-aminophenyl)-6-(diethylamino)xanthen-3-ylidene]-diethyl-ammonium chloride CAS Name: [9-(4-aminophenyl)-6-(diethylamino)-3-xanthenylidene]-diethylammonium chloride IUPAC Name: [9-(4-aminophenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium chloride Traditional Name: [9-(4-aminophenyl)-6-(diethylamino)xanthen-3-ylidene]-diethyl-ammonium chloride Formula: C27H32ClN3O MolecularWeight: 450.01548

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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)C4=CC=C(C=C4)N.[Cl-]

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=C(C=C4)N.[Cl-]

InChI

InChI=1S/C27H31N3O.ClH/c1-5-29(6-2)21-13-15-23-25(17-21)31-26-18-22(30(7-3)8-4)14-16-24(26)27(23)19-9-11-20(28)12-10-19;/h9-18,28H,5-8H2,1-4H3;1H