[9-(2-carboxyphenyl)-5,6,7,8-tetrahydroxanthen-3-ylidene]-diethyl-azanium

Systemtic Name: [9-(2-carboxyphenyl)-5,6,7,8-tetrahydroxanthen-3-ylidene]-diethyl-azanium Openeye Name: [9-(2-carboxyphenyl)-5,6,7,8-tetrahydroxanthen-3-ylidene]-diethyl-ammonium CAS Name: [9-(2-carboxyphenyl)-5,6,7,8-tetrahydroxanthen-3-ylidene]-diethylammonium IUPAC Name: [9-(2-carboxyphenyl)-5,6,7,8-tetrahydroxanthen-3-ylidene]-diethylazanium Traditional Name: [9-(2-carboxyphenyl)-5,6,7,8-tetrahydroxanthen-3-ylidene]-diethyl-ammonium Formula: C24H26NO3+ MolecularWeight: 376.46814

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](=C1C=CC2=C(C3=C(CCCC3)OC2=C1)C4=CC=CC=C4C(=O)O)CC

Isomeric SMILES

CC[N+](=C1C=CC2=C(C3=C(CCCC3)OC2=C1)C4=CC=CC=C4C(=O)O)CC

InChI

InChI=1S/C24H25NO3/c1-3-25(4-2)16-13-14-20-22(15-16)28-21-12-8-7-11-19(21)23(20)17-9-5-6-10-18(17)24(26)27/h5-6,9-10,13-15H,3-4,7-8,11-12H2,1-2H3/p+1