1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-4-(4-fluorophenyl)butane-1,4-dione

Systemtic Name: 1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-4-(4-fluorophenyl)butane-1,4-dione Openeye Name: 1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-4-(4-fluorophenyl)butane-1,4-dione CAS Name: 1-[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-4-(4-fluorophenyl)butane-1,4-dione IUPAC Name: 1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-4-(4-fluorophenyl)butane-1,4-dione Traditional Name: 1-[4-(3-chlorophenyl)sulfonylpiperazino]-4-(4-fluorophenyl)butane-1,4-dione Formula: C20H20ClFN2O4S MolecularWeight: 438.900203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H20ClFN2O4S/c21-16-2-1-3-18(14-16)29(27,28)24-12-10-23(11-13-24)20(26)9-8-19(25)15-4-6-17(22)7-5-15/h1-7,14H,8-13H2