N-[[1-(4-fluorophenyl)-5-phenyl-pyrazolo[3,4-f]isoquinolin-3-yl]methyl]piperidin-4-amine

Systemtic Name: N-[[1-(4-fluorophenyl)-5-phenyl-pyrazolo[3,4-f]isoquinolin-3-yl]methyl]piperidin-4-amine Openeye Name: N-[[1-(4-fluorophenyl)-5-phenyl-pyrazolo[3,4-f]isoquinolin-3-yl]methyl]piperidin-4-amine CAS Name: N-[[1-(4-fluorophenyl)-5-phenyl-3-pyrazolo[3,4-f]isoquinolinyl]methyl]-4-piperidinamine IUPAC Name: N-[[1-(4-fluorophenyl)-5-phenylpyrazolo[3,4-f]isoquinolin-3-yl]methyl]piperidin-4-amine Traditional Name: [1-(4-fluorophenyl)-5-phenyl-pyrazol[3,4-f]isoquinolin-3-yl]methyl-(4-piperidyl)amine Formula: C28H26FN5 MolecularWeight: 451.537943

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1NCC2=NN(C3=C4C=CN=CC4=C(C=C23)C5=CC=CC=C5)C6=CC=C(C=C6)F

Isomeric SMILES

C1CNCCC1NCC2=NN(C3=C4C=CN=CC4=C(C=C23)C5=CC=CC=C5)C6=CC=C(C=C6)F

InChI

InChI=1S/C28H26FN5/c29-20-6-8-22(9-7-20)34-28-23-12-15-31-17-26(23)24(19-4-2-1-3-5-19)16-25(28)27(33-34)18-32-21-10-13-30-14-11-21/h1-9,12,15-17,21,30,32H,10-11,13-14,18H2