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[9-(2,4-dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethyl-azanium

[9-(2,4-dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethyl-azanium

Systemtic Name:[9-(2,4-dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethyl-azanium
Openeye Name:[9-(2,4-dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethyl-ammonium
CAS Name:[9-(2,4-dicarboxyphenyl)-6-(diethylamino)-3-xanthenylidene]-diethylammonium
IUPAC Name:[9-(2,4-dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium
Traditional Name:[9-(2,4-dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethyl-ammonium
Formula: C29H31N2O5+
MolecularWeight: 487.56684
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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=C(C=C(C=C4)C(=O)O)C(=O)O


Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=C(C=C(C=C4)C(=O)O)C(=O)O


InChI

InChI=1S/C29H30N2O5/c1-5-30(6-2)19-10-13-22-25(16-19)36-26-17-20(31(7-3)8-4)11-14-23(26)27(22)21-12-9-18(28(32)33)15-24(21)29(34)35/h9-17H,5-8H2,1-4H3,(H-,32,33,34,35)/p+1


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