1-(4-fluorophenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium Openeye Name: 1-(4-fluorophenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium CAS Name: 1-(4-fluorophenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium IUPAC Name: 1-(4-fluorophenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium Traditional Name: 1-(4-fluorophenyl)sulfonyl-4-(3-methylbut-2-enyl)piperazin-4-ium Formula: C15H22FN2O2S+ MolecularWeight: 313.410783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)F)C

Isomeric SMILES

CC(=CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C15H21FN2O2S/c1-13(2)7-8-17-9-11-18(12-10-17)21(19,20)15-5-3-14(16)4-6-15/h3-7H,8-12H2,1-2H3/p+1