8-bromanyl-1,3-dimethyl-7H-purine-2,6-dione; cyclohexanamine

Systemtic Name: 8-bromanyl-1,3-dimethyl-7H-purine-2,6-dione; cyclohexanamine Openeye Name: 8-bromo-1,3-dimethyl-7H-purine-2,6-dione; cyclohexanamine CAS Name: 8-bromo-1,3-dimethyl-7H-purine-2,6-dione; cyclohexanamine IUPAC Name: 8-bromo-1,3-dimethyl-7H-purine-2,6-dione; cyclohexanamine Traditional Name: 8-bromo-1,3-dimethyl-7H-purine-2,6-quinone; cyclohexylamine Formula: C13H20BrN5O2 MolecularWeight: 358.2342

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Br.C1CCC(CC1)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Br.C1CCC(CC1)N

InChI

InChI=1S/C7H7BrN4O2.C6H13N/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14;7-6-4-2-1-3-5-6/h1-2H3,(H,9,10);6H,1-5,7H2