4-[3-(4-methylphenyl)sulfonylpropanoyl]piperazin-2-one

Systemtic Name: 4-[3-(4-methylphenyl)sulfonylpropanoyl]piperazin-2-one Openeye Name: 4-[3-(p-tolylsulfonyl)propanoyl]piperazin-2-one CAS Name: 4-[3-(4-methylphenyl)sulfonyl-1-oxopropyl]-2-piperazinone IUPAC Name: 4-[3-(4-methylphenyl)sulfonylpropanoyl]piperazin-2-one Traditional Name: 4-(3-tosylpropanoyl)piperazin-2-one Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CCNC(=O)C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CCNC(=O)C2

InChI

InChI=1S/C14H18N2O4S/c1-11-2-4-12(5-3-11)21(19,20)9-6-14(18)16-8-7-15-13(17)10-16/h2-5H,6-10H2,1H3,(H,15,17)