1-[(5-methylfuran-2-yl)methyl]-4-(4-methylphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-[(5-methylfuran-2-yl)methyl]-4-(4-methylphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-[(5-methyl-2-furyl)methyl]-4-(p-tolylsulfonyl)piperazin-1-ium CAS Name: 1-[(5-methyl-2-furanyl)methyl]-4-(4-methylphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-[(5-methylfuran-2-yl)methyl]-4-(4-methylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-[(5-methyl-2-furyl)methyl]-4-tosyl-piperazin-1-ium Formula: C17H23N2O3S+ MolecularWeight: 335.44112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=C(O3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=C(O3)C

InChI

InChI=1S/C17H22N2O3S/c1-14-3-7-17(8-4-14)23(20,21)19-11-9-18(10-12-19)13-16-6-5-15(2)22-16/h3-8H,9-13H2,1-2H3/p+1