[3-fluoranyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methylazanium

Systemtic Name: [3-fluoranyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methylazanium Openeye Name: [3-fluoro-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methylammonium CAS Name: [3-fluoro-4-[4-(2-pyrimidinyl)-1-piperazinyl]phenyl]methylammonium IUPAC Name: [3-fluoro-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methylazanium Traditional Name: [3-fluoro-4-[4-(2-pyrimidyl)piperazino]benzyl]ammonium Formula: C15H19FN5+ MolecularWeight: 288.343263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C[NH3+])F)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C[NH3+])F)C3=NC=CC=N3

InChI

InChI=1S/C15H18FN5/c16-13-10-12(11-17)2-3-14(13)20-6-8-21(9-7-20)15-18-4-1-5-19-15/h1-5,10H,6-9,11,17H2/p+1