1,4-dimethyl-6-nitro-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxaline-2,3-dione

Systemtic Name: 1,4-dimethyl-6-nitro-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxaline-2,3-dione Openeye Name: 1,4-dimethyl-6-nitro-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxaline-2,3-dione CAS Name: 1,4-dimethyl-6-nitro-7-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]quinoxaline-2,3-dione IUPAC Name: 1,4-dimethyl-6-nitro-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxaline-2,3-dione Traditional Name: 1,4-dimethyl-6-nitro-7-[4-[3-(trifluoromethyl)phenyl]piperazino]quinoxaline-2,3-quinone Formula: C21H20F3N5O4 MolecularWeight: 463.40981

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N(C(=O)C1=O)C)[N+](=O)[O-])N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CN1C2=CC(=C(C=C2N(C(=O)C1=O)C)[N+](=O)[O-])N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H20F3N5O4/c1-25-15-11-17(18(29(32)33)12-16(15)26(2)20(31)19(25)30)28-8-6-27(7-9-28)14-5-3-4-13(10-14)21(22,23)24/h3-5,10-12H,6-9H2,1-2H3