[9-(2-methoxycarbonylphenyl)-6-oxidanyl-xanthen-3-ylidene]-dimethyl-azanium chloride

Systemtic Name: [9-(2-methoxycarbonylphenyl)-6-oxidanyl-xanthen-3-ylidene]-dimethyl-azanium chloride Openeye Name: [6-hydroxy-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]-dimethyl-ammonium chloride CAS Name: [6-hydroxy-9-(2-methoxycarbonylphenyl)-3-xanthenylidene]-dimethylammonium chloride IUPAC Name: [6-hydroxy-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]-dimethylazanium chloride Traditional Name: [9-(2-carbomethoxyphenyl)-6-hydroxy-xanthen-3-ylidene]-dimethyl-ammonium chloride Formula: C23H20ClNO4 MolecularWeight: 409.8622

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C1C=CC2=C(C3=C(C=C(C=C3)O)OC2=C1)C4=CC=CC=C4C(=O)OC)C.[Cl-]

Isomeric SMILES

C[N+](=C1C=CC2=C(C3=C(C=C(C=C3)O)OC2=C1)C4=CC=CC=C4C(=O)OC)C.[Cl-]

InChI

InChI=1S/C23H19NO4.ClH/c1-24(2)14-8-10-18-20(12-14)28-21-13-15(25)9-11-19(21)22(18)16-6-4-5-7-17(16)23(26)27-3;/h4-13H,1-3H3;1H