1-[2-(4-methylphenyl)sulfonylethyl]-4-phenyl-piperazin-1-ium

Systemtic Name: 1-[2-(4-methylphenyl)sulfonylethyl]-4-phenyl-piperazin-1-ium Openeye Name: 1-phenyl-4-[2-(p-tolylsulfonyl)ethyl]piperazin-4-ium CAS Name: 1-[2-(4-methylphenyl)sulfonylethyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[2-(4-methylphenyl)sulfonylethyl]-4-phenylpiperazin-1-ium Traditional Name: 1-phenyl-4-(2-tosylethyl)piperazin-4-ium Formula: C19H25N2O2S+ MolecularWeight: 345.479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H24N2O2S/c1-17-7-9-19(10-8-17)24(22,23)16-15-20-11-13-21(14-12-20)18-5-3-2-4-6-18/h2-10H,11-16H2,1H3/p+1