6-azanyl-5-bromanyl-1-(8-diethoxyphosphoryloctyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-bromanyl-1-(8-diethoxyphosphoryloctyl)pyrimidine-2,4-dione Openeye Name: 6-amino-5-bromo-1-(8-diethoxyphosphoryloctyl)pyrimidine-2,4-dione CAS Name: 6-amino-5-bromo-1-(8-diethoxyphosphoryloctyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-5-bromo-1-(8-diethoxyphosphoryloctyl)pyrimidine-2,4-dione Traditional Name: 6-amino-5-bromo-1-(8-diethoxyphosphoryloctyl)pyrimidine-2,4-quinone Formula: C16H29BrN3O5P MolecularWeight: 454.296321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCCCCCCCN1C(=C(C(=O)NC1=O)Br)N)OCC

Isomeric SMILES

CCOP(=O)(CCCCCCCCN1C(=C(C(=O)NC1=O)Br)N)OCC

InChI

InChI=1S/C16H29BrN3O5P/c1-3-24-26(23,25-4-2)12-10-8-6-5-7-9-11-20-14(18)13(17)15(21)19-16(20)22/h3-12,18H2,1-2H3,(H,19,21,22)