7-[2-(cyclododecylamino)ethyl]-3-methyl-purine-2,6-dione

Systemtic Name: 7-[2-(cyclododecylamino)ethyl]-3-methyl-purine-2,6-dione Openeye Name: 7-[2-(cyclododecylamino)ethyl]-3-methyl-purine-2,6-dione CAS Name: 7-[2-(cyclododecylamino)ethyl]-3-methylpurine-2,6-dione IUPAC Name: 7-[2-(cyclododecylamino)ethyl]-3-methylpurine-2,6-dione Traditional Name: 7-[2-(cyclododecylamino)ethyl]-3-methyl-xanthine Formula: C20H33N5O2 MolecularWeight: 375.50832

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C=N2)CCNC3CCCCCCCCCCC3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C=N2)CCNC3CCCCCCCCCCC3

InChI

InChI=1S/C20H33N5O2/c1-24-18-17(19(26)23-20(24)27)25(15-22-18)14-13-21-16-11-9-7-5-3-2-4-6-8-10-12-16/h15-16,21H,2-14H2,1H3,(H,23,26,27)