2-(3-azanyl-6-oxidanylidene-xanthen-9-yl)-3,4,5,6-tetrakis(fluoranyl)benzoic acid

Systemtic Name: 2-(3-azanyl-6-oxidanylidene-xanthen-9-yl)-3,4,5,6-tetrakis(fluoranyl)benzoic acid Openeye Name: 2-(3-amino-6-oxo-xanthen-9-yl)-3,4,5,6-tetrafluoro-benzoic acid CAS Name: 2-(3-amino-6-oxo-9-xanthenyl)-3,4,5,6-tetrafluorobenzoic acid IUPAC Name: 2-(3-amino-6-oxoxanthen-9-yl)-3,4,5,6-tetrafluorobenzoic acid Traditional Name: 2-(3-amino-6-keto-xanthen-9-yl)-3,4,5,6-tetrafluoro-benzoic acid Formula: C20H9F4NO4 MolecularWeight: 403.283373

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N)OC3=CC(=O)C=CC3=C2C4=C(C(=C(C(=C4F)F)F)F)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1N)OC3=CC(=O)C=CC3=C2C4=C(C(=C(C(=C4F)F)F)F)C(=O)O

InChI

InChI=1S/C20H9F4NO4/c21-16-14(15(20(27)28)17(22)19(24)18(16)23)13-9-3-1-7(25)5-11(9)29-12-6-8(26)2-4-10(12)13/h1-6H,25H2,(H,27,28)