8-[11-(dodecylamino)-10-oxidanyl-undecyl]-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 8-[11-(dodecylamino)-10-oxidanyl-undecyl]-3,7-dimethyl-purine-2,6-dione Openeye Name: 8-[11-(dodecylamino)-10-hydroxy-undecyl]-3,7-dimethyl-purine-2,6-dione CAS Name: 8-[11-(dodecylamino)-10-hydroxyundecyl]-3,7-dimethylpurine-2,6-dione IUPAC Name: 8-[11-(dodecylamino)-10-hydroxyundecyl]-3,7-dimethylpurine-2,6-dione Traditional Name: 8-[10-hydroxy-11-(laurylamino)undecyl]-3,7-dimethyl-xanthine Formula: C30H55N5O3 MolecularWeight: 533.7894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNCC(CCCCCCCCCC1=NC2=C(N1C)C(=O)NC(=O)N2C)O

Isomeric SMILES

CCCCCCCCCCCCNCC(CCCCCCCCCC1=NC2=C(N1C)C(=O)NC(=O)N2C)O

InChI

InChI=1S/C30H55N5O3/c1-4-5-6-7-8-9-10-14-17-20-23-31-24-25(36)21-18-15-12-11-13-16-19-22-26-32-28-27(34(26)2)29(37)33-30(38)35(28)3/h25,31,36H,4-24H2,1-3H3,(H,33,37,38)