4-[3,4-bis(fluoranyl)phenyl]sulfonyl-1-phenethyl-piperazine-2,6-dione

Systemtic Name: 4-[3,4-bis(fluoranyl)phenyl]sulfonyl-1-phenethyl-piperazine-2,6-dione Openeye Name: 4-(3,4-difluorophenyl)sulfonyl-1-phenethyl-piperazine-2,6-dione CAS Name: 4-(3,4-difluorophenyl)sulfonyl-1-phenethylpiperazine-2,6-dione IUPAC Name: 4-(3,4-difluorophenyl)sulfonyl-1-phenethylpiperazine-2,6-dione Traditional Name: 4-(3,4-difluorophenyl)sulfonyl-1-phenethyl-piperazine-2,6-quinone Formula: C18H16F2N2O4S MolecularWeight: 394.392446

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=O)CN1S(=O)(=O)C2=CC(=C(C=C2)F)F)CCC3=CC=CC=C3

Isomeric SMILES

C1C(=O)N(C(=O)CN1S(=O)(=O)C2=CC(=C(C=C2)F)F)CCC3=CC=CC=C3

InChI

InChI=1S/C18H16F2N2O4S/c19-15-7-6-14(10-16(15)20)27(25,26)21-11-17(23)22(18(24)12-21)9-8-13-4-2-1-3-5-13/h1-7,10H,8-9,11-12H2