3-(trifluoromethylsulfonyl)-1H-1,10-phenanthrolin-4-one

Systemtic Name: 3-(trifluoromethylsulfonyl)-1H-1,10-phenanthrolin-4-one Openeye Name: 3-(trifluoromethylsulfonyl)-1H-1,10-phenanthrolin-4-one CAS Name: 3-(trifluoromethylsulfonyl)-1H-1,10-phenanthrolin-4-one IUPAC Name: 3-(trifluoromethylsulfonyl)-1H-1,10-phenanthrolin-4-one Traditional Name: 3-triflyl-1H-1,10-phenanthrolin-4-one Formula: C13H7F3N2O3S MolecularWeight: 328.26649

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C3=C(C=C2)C(=O)C(=CN3)S(=O)(=O)C(F)(F)F)N=C1

Isomeric SMILES

C1=CC2=C(C3=C(C=C2)C(=O)C(=CN3)S(=O)(=O)C(F)(F)F)N=C1

InChI

InChI=1S/C13H7F3N2O3S/c14-13(15,16)22(20,21)9-6-18-11-8(12(9)19)4-3-7-2-1-5-17-10(7)11/h1-6H,(H,18,19)