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

Systemtic Name: 1-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[1-(4-chlorophenyl)sulfonyl-4-piperidyl]-4-(2-methoxyphenyl)piperazin-1-ium CAS Name: 1-[1-(4-chlorophenyl)sulfonyl-4-piperidinyl]-4-(2-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium Traditional Name: 1-[1-(4-chlorophenyl)sulfonyl-4-piperidyl]-4-(2-methoxyphenyl)piperazin-1-ium Formula: C22H29ClN3O3S+ MolecularWeight: 451.00196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H28ClN3O3S/c1-29-22-5-3-2-4-21(22)25-16-14-24(15-17-25)19-10-12-26(13-11-19)30(27,28)20-8-6-18(23)7-9-20/h2-9,19H,10-17H2,1H3/p+1