3,7-dimethyl-1-[16-(oxiran-2-yl)hexadecyl]purine-2,6-dione

Systemtic Name: 3,7-dimethyl-1-[16-(oxiran-2-yl)hexadecyl]purine-2,6-dione Openeye Name: 3,7-dimethyl-1-[16-(oxiran-2-yl)hexadecyl]purine-2,6-dione CAS Name: 3,7-dimethyl-1-[16-(2-oxiranyl)hexadecyl]purine-2,6-dione IUPAC Name: 3,7-dimethyl-1-[16-(oxiran-2-yl)hexadecyl]purine-2,6-dione Traditional Name: 3,7-dimethyl-1-[16-(oxiran-2-yl)hexadecyl]xanthine Formula: C25H42N4O3 MolecularWeight: 446.62598

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCCCCCCCCC3CO3

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCCCCCCCCC3CO3

InChI

InChI=1S/C25H42N4O3/c1-27-20-26-23-22(27)24(30)29(25(31)28(23)2)18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-21-19-32-21/h20-21H,3-19H2,1-2H3