1-(2-methoxyphenyl)-4-(4-methylphenyl)sulfonyl-piperazin-1-ium chloride

Systemtic Name: 1-(2-methoxyphenyl)-4-(4-methylphenyl)sulfonyl-piperazin-1-ium chloride Openeye Name: 1-(2-methoxyphenyl)-4-(p-tolylsulfonyl)piperazin-1-ium chloride CAS Name: 1-(2-methoxyphenyl)-4-(4-methylphenyl)sulfonylpiperazin-1-ium chloride IUPAC Name: 1-(2-methoxyphenyl)-4-(4-methylphenyl)sulfonylpiperazin-1-ium chloride Traditional Name: 1-(2-methoxyphenyl)-4-tosyl-piperazin-1-ium chloride Formula: C18H23ClN2O3S MolecularWeight: 382.90482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C3=CC=CC=C3OC.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C3=CC=CC=C3OC.[Cl-]

InChI

InChI=1S/C18H22N2O3S.ClH/c1-15-7-9-16(10-8-15)24(21,22)20-13-11-19(12-14-20)17-5-3-4-6-18(17)23-2;/h3-10H,11-14H2,1-2H3;1H