[8-[3,4-bis(azanyl)-2-carboxy-phenyl]-5-(dimethylamino)xanthen-3-ylidene]-dimethyl-azanium

Systemtic Name: [8-[3,4-bis(azanyl)-2-carboxy-phenyl]-5-(dimethylamino)xanthen-3-ylidene]-dimethyl-azanium Openeye Name: [8-(3,4-diamino-2-carboxy-phenyl)-5-(dimethylamino)xanthen-3-ylidene]-dimethyl-ammonium CAS Name: [8-(3,4-diamino-2-carboxyphenyl)-5-(dimethylamino)-3-xanthenylidene]-dimethylammonium IUPAC Name: [8-(3,4-diamino-2-carboxyphenyl)-5-(dimethylamino)xanthen-3-ylidene]-dimethylazanium Traditional Name: [8-(3,4-diamino-2-carboxy-phenyl)-5-(dimethylamino)xanthen-3-ylidene]-dimethyl-ammonium Formula: C24H25N4O3+ MolecularWeight: 417.4803

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C2C(=C(C=C1)C3=C(C(=C(C=C3)N)N)C(=O)O)C=C4C=CC(=[N+](C)C)C=C4O2

Isomeric SMILES

CN(C)C1=C2C(=C(C=C1)C3=C(C(=C(C=C3)N)N)C(=O)O)C=C4C=CC(=[N+](C)C)C=C4O2

InChI

InChI=1S/C24H24N4O3/c1-27(2)14-6-5-13-11-17-15(16-7-9-18(25)22(26)21(16)24(29)30)8-10-19(28(3)4)23(17)31-20(13)12-14/h5-12,25H,26H2,1-4H3,(H,29,30)/p+1