1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]pentane-1,4-dione

Systemtic Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]pentane-1,4-dione Openeye Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]pentane-1,4-dione CAS Name: 1-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]pentane-1,4-dione IUPAC Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]pentane-1,4-dione Traditional Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazino]pentane-1,4-dione Formula: C17H24N2O4S MolecularWeight: 352.44846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O4S/c1-13-4-6-16(14(2)12-13)24(22,23)19-10-8-18(9-11-19)17(21)7-5-15(3)20/h4,6,12H,5,7-11H2,1-3H3