3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]oxolan-2-one

Systemtic Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]oxolan-2-one Openeye Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]tetrahydrofuran-2-one CAS Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-2-oxolanone IUPAC Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]oxolan-2-one Traditional Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]tetrahydrofuran-2-one Formula: C15H16F3N3O4 MolecularWeight: 359.30045

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1COC(=O)C1N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H16F3N3O4/c16-15(17,18)10-1-2-11(13(9-10)21(23)24)19-4-6-20(7-5-19)12-3-8-25-14(12)22/h1-2,9,12H,3-8H2