1-(2,4-dichlorophenyl)-3-(4-fluorophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 1-(2,4-dichlorophenyl)-3-(4-fluorophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(2,4-dichlorophenyl)-3-(4-fluorophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(2,4-dichlorophenyl)-3-(4-fluorophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(2,4-dichlorophenyl)-3-(4-fluorophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(2,4-dichlorophenyl)-3-(4-fluorophenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C19H16Cl2FN3 MolecularWeight: 376.254843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16Cl2FN3/c20-13-6-9-17(16(21)11-13)25-19-15(3-1-2-10-23-19)18(24-25)12-4-7-14(22)8-5-12/h4-9,11,24H,1-3,10H2