2-[4-[[3-(4-fluorophenyl)oxolan-3-yl]methylamino]phenyl]-5-methyl-4H-pyrazol-3-one

Systemtic Name: 2-[4-[[3-(4-fluorophenyl)oxolan-3-yl]methylamino]phenyl]-5-methyl-4H-pyrazol-3-one Openeye Name: 2-[4-[[3-(4-fluorophenyl)tetrahydrofuran-3-yl]methylamino]phenyl]-5-methyl-4H-pyrazol-3-one CAS Name: 2-[4-[[3-(4-fluorophenyl)-3-oxolanyl]methylamino]phenyl]-5-methyl-4H-pyrazol-3-one IUPAC Name: 2-[4-[[3-(4-fluorophenyl)oxolan-3-yl]methylamino]phenyl]-5-methyl-4H-pyrazol-3-one Traditional Name: 2-[4-[[3-(4-fluorophenyl)tetrahydrofuran-3-yl]methylamino]phenyl]-5-methyl-2-pyrazolin-3-one Formula: C21H22FN3O2 MolecularWeight: 367.416683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C2=CC=C(C=C2)NCC3(CCOC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=O)C1)C2=CC=C(C=C2)NCC3(CCOC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O2/c1-15-12-20(26)25(24-15)19-8-6-18(7-9-19)23-13-21(10-11-27-14-21)16-2-4-17(22)5-3-16/h2-9,23H,10-14H2,1H3