6-[(E)-2-(5-bromanyl-3-methyl-2-oxidanyl-phenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione

Systemtic Name: 6-[(E)-2-(5-bromanyl-3-methyl-2-oxidanyl-phenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Openeye Name: 6-[(E)-2-(5-bromo-2-hydroxy-3-methyl-phenyl)vinyl]-5-nitro-1H-pyrimidine-2,4-dione CAS Name: 6-[(E)-2-(5-bromo-2-hydroxy-3-methylphenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione IUPAC Name: 6-[(E)-2-(5-bromo-2-hydroxy-3-methylphenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Traditional Name: 6-[(E)-2-(5-bromo-2-hydroxy-3-methyl-phenyl)vinyl]-5-nitro-uracil Formula: C13H10BrN3O5 MolecularWeight: 368.1396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)/C=C/C2=C(C(=O)NC(=O)N2)[N+](=O)[O-])O

InChI

InChI=1S/C13H10BrN3O5/c1-6-4-8(14)5-7(11(6)18)2-3-9-10(17(21)22)12(19)16-13(20)15-9/h2-5,18H,1H3,(H2,15,16,19,20)/b3-2+