1-(4-chlorophenyl)-4-[4-(2-methyl-2-oxidanyl-propyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-chlorophenyl)-4-[4-(2-methyl-2-oxidanyl-propyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-chlorophenyl)-4-[4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(4-chlorophenyl)-4-[4-(2-hydroxy-2-methylpropyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-chlorophenyl)-4-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(4-chlorophenyl)-4-[4-(2-hydroxy-2-methyl-propyl)piperazino]butane-1,4-dione Formula: C18H25ClN2O3 MolecularWeight: 352.8557

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CCN(CC1)C(=O)CCC(=O)C2=CC=C(C=C2)Cl)O

Isomeric SMILES

CC(C)(CN1CCN(CC1)C(=O)CCC(=O)C2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C18H25ClN2O3/c1-18(2,24)13-20-9-11-21(12-10-20)17(23)8-7-16(22)14-3-5-15(19)6-4-14/h3-6,24H,7-13H2,1-2H3