1-[(3-fluorophenyl)methyl]-4-[(E)-2-phenylethenyl]sulfonyl-piperazin-1-ium

Systemtic Name: 1-[(3-fluorophenyl)methyl]-4-[(E)-2-phenylethenyl]sulfonyl-piperazin-1-ium Openeye Name: 1-[(3-fluorophenyl)methyl]-4-[(E)-styryl]sulfonyl-piperazin-1-ium CAS Name: 1-[(3-fluorophenyl)methyl]-4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium IUPAC Name: 1-[(3-fluorophenyl)methyl]-4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium Traditional Name: 1-(3-fluorobenzyl)-4-[(E)-styryl]sulfonyl-piperazin-1-ium Formula: C19H22FN2O2S+ MolecularWeight: 361.453583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)F)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)F)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C19H21FN2O2S/c20-19-8-4-7-18(15-19)16-21-10-12-22(13-11-21)25(23,24)14-9-17-5-2-1-3-6-17/h1-9,14-15H,10-13,16H2/p+1/b14-9+