9-(3-bromanylpropyl)-N-[2,2,2-tris(fluoranyl)ethyl]xanthene-9-carboxamide

Systemtic Name: 9-(3-bromanylpropyl)-N-[2,2,2-tris(fluoranyl)ethyl]xanthene-9-carboxamide Openeye Name: 9-(3-bromopropyl)-N-(2,2,2-trifluoroethyl)xanthene-9-carboxamide CAS Name: 9-(3-bromopropyl)-N-(2,2,2-trifluoroethyl)-9-xanthenecarboxamide IUPAC Name: 9-(3-bromopropyl)-N-(2,2,2-trifluoroethyl)xanthene-9-carboxamide Traditional Name: 9-(3-bromopropyl)-N-(2,2,2-trifluoroethyl)xanthene-9-carboxamide Formula: C19H17BrF3NO2 MolecularWeight: 428.24299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)(CCCBr)C(=O)NCC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)(CCCBr)C(=O)NCC(F)(F)F

InChI

InChI=1S/C19H17BrF3NO2/c20-11-5-10-18(17(25)24-12-19(21,22)23)13-6-1-3-8-15(13)26-16-9-4-2-7-14(16)18/h1-4,6-9H,5,10-12H2,(H,24,25)