7-cyclohexyl-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidin-6-ium-2,4-dione

Systemtic Name: 7-cyclohexyl-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidin-6-ium-2,4-dione Openeye Name: 7-cyclohexyl-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidin-6-ium-2,4-dione CAS Name: 7-cyclohexyl-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidin-6-ium-2,4-dione IUPAC Name: 7-cyclohexyl-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidin-6-ium-2,4-dione Traditional Name: 7-cyclohexyl-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidin-6-ium-2,4-quinone Formula: C20H19F6N4O2+ MolecularWeight: 461.380879

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=[NH+]C(C3=C(N2)N(C(=O)NC3=O)C4=CC=CC=C4)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)C2=[NH+]C(C3=C(N2)N(C(=O)NC3=O)C4=CC=CC=C4)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C20H18F6N4O2/c21-19(22,23)18(20(24,25)26)13-15(27-14(29-18)11-7-3-1-4-8-11)30(17(32)28-16(13)31)12-9-5-2-6-10-12/h2,5-6,9-11H,1,3-4,7-8H2,(H,27,29)(H,28,31,32)/p+1