[4-(4-ethanoylpiperazin-1-yl)-3-fluoranyl-phenyl]methylazanium

Systemtic Name: [4-(4-ethanoylpiperazin-1-yl)-3-fluoranyl-phenyl]methylazanium Openeye Name: [4-(4-acetylpiperazin-1-yl)-3-fluoro-phenyl]methylammonium CAS Name: [4-(4-acetyl-1-piperazinyl)-3-fluorophenyl]methylammonium IUPAC Name: [4-(4-acetylpiperazin-1-yl)-3-fluorophenyl]methylazanium Traditional Name: [4-(4-acetylpiperazino)-3-fluoro-benzyl]ammonium Formula: C13H19FN3O+ MolecularWeight: 252.307863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C[NH3+])F

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C[NH3+])F

InChI

InChI=1S/C13H18FN3O/c1-10(18)16-4-6-17(7-5-16)13-3-2-11(9-15)8-12(13)14/h2-3,8H,4-7,9,15H2,1H3/p+1