7-(4-bromanylcyclohexyl)-1,3-dimethyl-4,6-dihydro-2H-pteridin-5-ium 5-oxide

Systemtic Name: 7-(4-bromanylcyclohexyl)-1,3-dimethyl-4,6-dihydro-2H-pteridin-5-ium 5-oxide Openeye Name: 7-(4-bromocyclohexyl)-1,3-dimethyl-4,6-dihydro-2H-pteridin-5-ium 5-oxide CAS Name: 7-(4-bromocyclohexyl)-1,3-dimethyl-4,6-dihydro-2H-pteridin-5-ium 5-oxide IUPAC Name: 7-(4-bromocyclohexyl)-1,3-dimethyl-4,6-dihydro-2H-pteridin-5-ium 5-oxide Traditional Name: 7-(4-bromocyclohexyl)-1,3-dimethyl-4,6-dihydro-2H-pteridin-5-ium 5-oxide Formula: C14H22BrN4O+ MolecularWeight: 342.25468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(N=C(C[N+]2=O)C3CCC(CC3)Br)N(C1)C

Isomeric SMILES

CN1CC2=C(N=C(C[N+]2=O)C3CCC(CC3)Br)N(C1)C

InChI

InChI=1S/C14H22BrN4O/c1-17-8-13-14(18(2)9-17)16-12(7-19(13)20)10-3-5-11(15)6-4-10/h10-11H,3-9H2,1-2H3/q+1