8-(cyclohexen-1-ylmethyl)-1,3,7-trimethyl-purine-2,6-dione

Systemtic Name: 8-(cyclohexen-1-ylmethyl)-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-(cyclohexen-1-ylmethyl)-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-(1-cyclohexenylmethyl)-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-(cyclohexen-1-ylmethyl)-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-(cyclohexen-1-ylmethyl)-1,3,7-trimethyl-xanthine Formula: C15H20N4O2 MolecularWeight: 288.3449

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CC3=CCCCC3

Isomeric SMILES

CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CC3=CCCCC3

InChI

InChI=1S/C15H20N4O2/c1-17-11(9-10-7-5-4-6-8-10)16-13-12(17)14(20)19(3)15(21)18(13)2/h7H,4-6,8-9H2,1-3H3