5-[[bis[2,2,3,3-tetrakis(fluoranyl)propoxy]phosphoryl-(4-bromophenyl)methyl]amino]-1H-pyrimidine-2,4-dione

Systemtic Name: 5-[[bis[2,2,3,3-tetrakis(fluoranyl)propoxy]phosphoryl-(4-bromophenyl)methyl]amino]-1H-pyrimidine-2,4-dione Openeye Name: 5-[[bis(2,2,3,3-tetrafluoropropoxy)phosphoryl-(4-bromophenyl)methyl]amino]-1H-pyrimidine-2,4-dione CAS Name: 5-[[bis(2,2,3,3-tetrafluoropropoxy)phosphoryl-(4-bromophenyl)methyl]amino]-1H-pyrimidine-2,4-dione IUPAC Name: 5-[[bis(2,2,3,3-tetrafluoropropoxy)phosphoryl-(4-bromophenyl)methyl]amino]-1H-pyrimidine-2,4-dione Traditional Name: 5-[[bis(2,2,3,3-tetrafluoropropoxy)phosphoryl-(4-bromophenyl)methyl]amino]uracil Formula: C17H15BrF8N3O5P MolecularWeight: 604.183087

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(NC2=CNC(=O)NC2=O)P(=O)(OCC(C(F)F)(F)F)OCC(C(F)F)(F)F)Br

Isomeric SMILES

C1=CC(=CC=C1C(NC2=CNC(=O)NC2=O)P(=O)(OCC(C(F)F)(F)F)OCC(C(F)F)(F)F)Br

InChI

InChI=1S/C17H15BrF8N3O5P/c18-9-3-1-8(2-4-9)12(28-10-5-27-15(31)29-11(10)30)35(32,33-6-16(23,24)13(19)20)34-7-17(25,26)14(21)22/h1-5,12-14,28H,6-7H2,(H2,27,29,30,31)