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

Systemtic Name: [3-(4-ethanoylpiperazin-1-yl)sulfonyl-4-fluoranyl-phenyl]methylazanium Openeye Name: [3-(4-acetylpiperazin-1-yl)sulfonyl-4-fluoro-phenyl]methylammonium CAS Name: [3-[(4-acetyl-1-piperazinyl)sulfonyl]-4-fluorophenyl]methylammonium IUPAC Name: [3-(4-acetylpiperazin-1-yl)sulfonyl-4-fluorophenyl]methylazanium Traditional Name: [3-(4-acetylpiperazino)sulfonyl-4-fluoro-benzyl]ammonium Formula: C13H19FN3O3S+ MolecularWeight: 316.371663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18FN3O3S/c1-10(18)16-4-6-17(7-5-16)21(19,20)13-8-11(9-15)2-3-12(13)14/h2-3,8H,4-7,9,15H2,1H3/p+1