4-cyclohexyl-6-nitro-1-[2,2,2-tris(fluoranyl)ethyl]quinazolin-2-one

Systemtic Name: 4-cyclohexyl-6-nitro-1-[2,2,2-tris(fluoranyl)ethyl]quinazolin-2-one Openeye Name: 4-cyclohexyl-6-nitro-1-(2,2,2-trifluoroethyl)quinazolin-2-one CAS Name: 4-cyclohexyl-6-nitro-1-(2,2,2-trifluoroethyl)-2-quinazolinone IUPAC Name: 4-cyclohexyl-6-nitro-1-(2,2,2-trifluoroethyl)quinazolin-2-one Traditional Name: 4-cyclohexyl-6-nitro-1-(2,2,2-trifluoroethyl)quinazolin-2-one Formula: C16H16F3N3O3 MolecularWeight: 355.31175

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(=O)N(C3=C2C=C(C=C3)[N+](=O)[O-])CC(F)(F)F

Isomeric SMILES

C1CCC(CC1)C2=NC(=O)N(C3=C2C=C(C=C3)[N+](=O)[O-])CC(F)(F)F

InChI

InChI=1S/C16H16F3N3O3/c17-16(18,19)9-21-13-7-6-11(22(24)25)8-12(13)14(20-15(21)23)10-4-2-1-3-5-10/h6-8,10H,1-5,9H2