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

Systemtic Name: 1-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-phenylpiperazin-1-ium Traditional Name: 1-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-4-phenyl-piperazin-1-ium Formula: C22H30N3O3S+ MolecularWeight: 416.5569

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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=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O3S/c1-28-21-7-9-22(10-8-21)29(26,27)25-13-11-20(12-14-25)24-17-15-23(16-18-24)19-5-3-2-4-6-19/h2-10,20H,11-18H2,1H3/p+1