(4-bromanyl-2-fluoranyl-phenyl) 9H-xanthene-9-carboxylate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl) 9H-xanthene-9-carboxylate Openeye Name: (4-bromo-2-fluoro-phenyl) 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic acid (4-bromo-2-fluorophenyl) ester IUPAC Name: (4-bromo-2-fluorophenyl) 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid (4-bromo-2-fluoro-phenyl) ester Formula: C20H12BrFO3 MolecularWeight: 399.209883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)OC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)OC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C20H12BrFO3/c21-12-9-10-18(15(22)11-12)25-20(23)19-13-5-1-3-7-16(13)24-17-8-4-2-6-14(17)19/h1-11,19H