6-[4-(9H-fluoren-2-ylcarbamoyl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-olate

Systemtic Name: 6-[4-(9H-fluoren-2-ylcarbamoyl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-olate Openeye Name: 6-[4-(9H-fluoren-2-ylcarbamoyl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-olate CAS Name: 6-[4-[(9H-fluoren-2-ylamino)-oxomethyl]-5-(trifluoromethyl)-1-pyrazolyl]-3-pyridazinolate IUPAC Name: 6-[4-(9H-fluoren-2-ylcarbamoyl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-olate Traditional Name: 6-[4-(9H-fluoren-2-ylcarbamoyl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-olate Formula: C22H13F3N5O2- MolecularWeight: 436.36613

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3=C1C=C(C=C3)NC(=O)C4=C(N(N=C4)C5=NN=C(C=C5)[O-])C(F)(F)F

Isomeric SMILES

C1C2=CC=CC=C2C3=C1C=C(C=C3)NC(=O)C4=C(N(N=C4)C5=NN=C(C=C5)[O-])C(F)(F)F

InChI

InChI=1S/C22H14F3N5O2/c23-22(24,25)20-17(11-26-30(20)18-7-8-19(31)29-28-18)21(32)27-14-5-6-16-13(10-14)9-12-3-1-2-4-15(12)16/h1-8,10-11H,9H2,(H,27,32)(H,29,31)/p-1