1-(2-fluorophenyl)-4-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]piperazin-4-ium

Systemtic Name: 1-(2-fluorophenyl)-4-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]piperazin-4-ium Openeye Name: 1-(2-fluorophenyl)-4-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]piperazin-4-ium CAS Name: 1-(2-fluorophenyl)-4-[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]piperazin-4-ium IUPAC Name: 1-(2-fluorophenyl)-4-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]piperazin-4-ium Traditional Name: 1-(2-fluorophenyl)-4-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]piperazin-4-ium Formula: C22H29FN3O3S+ MolecularWeight: 434.547363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)[NH+]3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)[NH+]3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C22H28FN3O3S/c1-29-19-6-8-20(9-7-19)30(27,28)26-12-10-18(11-13-26)24-14-16-25(17-15-24)22-5-3-2-4-21(22)23/h2-9,18H,10-17H2,1H3/p+1