3-(furan-2-yl)-1-[4-(trifluoromethyloxy)phenyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 3-(furan-2-yl)-1-[4-(trifluoromethyloxy)phenyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 3-(2-furyl)-1-[4-(trifluoromethoxy)phenyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 3-(2-furanyl)-1-[4-(trifluoromethoxy)phenyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 3-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 3-(2-furyl)-1-[4-(trifluoromethoxy)phenyl]-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C18H16F3N3O2 MolecularWeight: 363.33375

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C2C(=C(NN2C3=CC=C(C=C3)OC(F)(F)F)C4=CC=CO4)C1

Isomeric SMILES

C1CCN=C2C(=C(NN2C3=CC=C(C=C3)OC(F)(F)F)C4=CC=CO4)C1

InChI

InChI=1S/C18H16F3N3O2/c19-18(20,21)26-13-8-6-12(7-9-13)24-17-14(4-1-2-10-22-17)16(23-24)15-5-3-11-25-15/h3,5-9,11,23H,1-2,4,10H2