methyl 4-(4-methylphenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: methyl 4-(4-methylphenyl)sulfonylpiperazine-1-carboxylate Openeye Name: methyl 4-(p-tolylsulfonyl)piperazine-1-carboxylate CAS Name: 4-(4-methylphenyl)sulfonyl-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-tosylpiperazine-1-carboxylic acid methyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC

InChI

InChI=1S/C13H18N2O4S/c1-11-3-5-12(6-4-11)20(17,18)15-9-7-14(8-10-15)13(16)19-2/h3-6H,7-10H2,1-2H3