1-(4-ethoxyphenyl)sulfonyl-4-[(4-fluorophenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(4-ethoxyphenyl)sulfonyl-4-[(4-fluorophenyl)methyl]piperazin-4-ium Openeye Name: 1-(4-ethoxyphenyl)sulfonyl-4-[(4-fluorophenyl)methyl]piperazin-4-ium CAS Name: 1-(4-ethoxyphenyl)sulfonyl-4-[(4-fluorophenyl)methyl]piperazin-4-ium IUPAC Name: 1-(4-ethoxyphenyl)sulfonyl-4-[(4-fluorophenyl)methyl]piperazin-4-ium Traditional Name: 1-(4-fluorobenzyl)-4-p-phenetylsulfonyl-piperazin-1-ium Formula: C19H24FN2O3S+ MolecularWeight: 379.468863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C19H23FN2O3S/c1-2-25-18-7-9-19(10-8-18)26(23,24)22-13-11-21(12-14-22)15-16-3-5-17(20)6-4-16/h3-10H,2,11-15H2,1H3/p+1