8-chloranyl-3-(2-cyclohexylethyl)-7H-purine-2,6-dione

Systemtic Name: 8-chloranyl-3-(2-cyclohexylethyl)-7H-purine-2,6-dione Openeye Name: 8-chloro-3-(2-cyclohexylethyl)-7H-purine-2,6-dione CAS Name: 8-chloro-3-(2-cyclohexylethyl)-7H-purine-2,6-dione IUPAC Name: 8-chloro-3-(2-cyclohexylethyl)-7H-purine-2,6-dione Traditional Name: 8-chloro-3-(2-cyclohexylethyl)-7H-purine-2,6-quinone Formula: C13H17ClN4O2 MolecularWeight: 296.75268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCN2C3=C(C(=O)NC2=O)NC(=N3)Cl

Isomeric SMILES

C1CCC(CC1)CCN2C3=C(C(=O)NC2=O)NC(=N3)Cl

InChI

InChI=1S/C13H17ClN4O2/c14-12-15-9-10(16-12)18(13(20)17-11(9)19)7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H,15,16)(H,17,19,20)