3-(2-bromoethyl)-1-[6-(oxiran-2-yl)hexyl]-7H-purine-2,6-dione

Systemtic Name: 3-(2-bromoethyl)-1-[6-(oxiran-2-yl)hexyl]-7H-purine-2,6-dione Openeye Name: 3-(2-bromoethyl)-1-[6-(oxiran-2-yl)hexyl]-7H-purine-2,6-dione CAS Name: 3-(2-bromoethyl)-1-[6-(2-oxiranyl)hexyl]-7H-purine-2,6-dione IUPAC Name: 3-(2-bromoethyl)-1-[6-(oxiran-2-yl)hexyl]-7H-purine-2,6-dione Traditional Name: 3-(2-bromoethyl)-1-[6-(oxiran-2-yl)hexyl]-7H-purine-2,6-quinone Formula: C15H21BrN4O3 MolecularWeight: 385.25624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)CCCCCCN2C(=O)C3=C(N=CN3)N(C2=O)CCBr

Isomeric SMILES

C1C(O1)CCCCCCN2C(=O)C3=C(N=CN3)N(C2=O)CCBr

InChI

InChI=1S/C15H21BrN4O3/c16-6-8-19-13-12(17-10-18-13)14(21)20(15(19)22)7-4-2-1-3-5-11-9-23-11/h10-11H,1-9H2,(H,17,18)