1-[4-(phenylsulfonyl)piperazin-1-yl]dodecan-1-one

Systemtic Name: 1-[4-(phenylsulfonyl)piperazin-1-yl]dodecan-1-one Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]dodecan-1-one CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-1-dodecanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]dodecan-1-one Traditional Name: 1-(4-besylpiperazino)dodecan-1-one Formula: C22H36N2O3S MolecularWeight: 408.59784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H36N2O3S/c1-2-3-4-5-6-7-8-9-13-16-22(25)23-17-19-24(20-18-23)28(26,27)21-14-11-10-12-15-21/h10-12,14-15H,2-9,13,16-20H2,1H3