2-(7-chloranyl-1-oxidanyl-9-oxidanylidene-xanthen-3-yl)oxyethanoate

Systemtic Name: 2-(7-chloranyl-1-oxidanyl-9-oxidanylidene-xanthen-3-yl)oxyethanoate Openeye Name: 2-(7-chloro-1-hydroxy-9-oxo-xanthen-3-yl)oxyacetate CAS Name: 2-[(7-chloro-1-hydroxy-9-oxo-3-xanthenyl)oxy]acetate IUPAC Name: 2-(7-chloro-1-hydroxy-9-oxoxanthen-3-yl)oxyacetate Traditional Name: 2-(7-chloro-1-hydroxy-9-keto-xanthen-3-yl)oxyacetate Formula: C15H8ClO6- MolecularWeight: 319.67342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=O)C3=C(C=C(C=C3O2)OCC(=O)[O-])O

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=O)C3=C(C=C(C=C3O2)OCC(=O)[O-])O

InChI

InChI=1S/C15H9ClO6/c16-7-1-2-11-9(3-7)15(20)14-10(17)4-8(5-12(14)22-11)21-6-13(18)19/h1-5,17H,6H2,(H,18,19)/p-1