1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pentane-1,4-dione

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pentane-1,4-dione Openeye Name: 1-[4-(p-tolylsulfonyl)piperazin-1-yl]pentane-1,4-dione CAS Name: 1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]pentane-1,4-dione IUPAC Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pentane-1,4-dione Traditional Name: 1-(4-tosylpiperazino)pentane-1,4-dione Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4S/c1-13-3-6-15(7-4-13)23(21,22)18-11-9-17(10-12-18)16(20)8-5-14(2)19/h3-4,6-7H,5,8-12H2,1-2H3