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2-xanthen-10-ium-9-ylbenzoic acid

2-xanthen-10-ium-9-ylbenzoic acid

Systemtic Name:2-xanthen-10-ium-9-ylbenzoic acid
Openeye Name:2-xanthen-10-ium-9-ylbenzoic acid
CAS Name:2-(9-xanthen-10-iumyl)benzoic acid
IUPAC Name:2-xanthen-10-ium-9-ylbenzoic acid
Traditional Name:2-xanthen-10-ium-9-ylbenzoic acid
Formula: C20H13O3+
MolecularWeight: 301.31542
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C3C=CC=CC3=[O+]C4=CC=CC=C42)C(=O)O


Isomeric SMILES

C1=CC=C(C(=C1)C2=C3C=CC=CC3=[O+]C4=CC=CC=C42)C(=O)O


InChI

InChI=1S/C20H12O3/c21-20(22)14-8-2-1-7-13(14)19-15-9-3-5-11-17(15)23-18-12-6-4-10-16(18)19/h1-12H/p+1


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