1-[11-(hexylamino)undecyl]-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 1-[11-(hexylamino)undecyl]-3,7-dimethyl-purine-2,6-dione Openeye Name: 1-[11-(hexylamino)undecyl]-3,7-dimethyl-purine-2,6-dione CAS Name: 1-[11-(hexylamino)undecyl]-3,7-dimethylpurine-2,6-dione IUPAC Name: 1-[11-(hexylamino)undecyl]-3,7-dimethylpurine-2,6-dione Traditional Name: 1-[11-(hexylamino)undecyl]-3,7-dimethyl-xanthine Formula: C24H43N5O2 MolecularWeight: 433.63052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCCCCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C

Isomeric SMILES

CCCCCCNCCCCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C

InChI

InChI=1S/C24H43N5O2/c1-4-5-6-14-17-25-18-15-12-10-8-7-9-11-13-16-19-29-23(30)21-22(26-20-27(21)2)28(3)24(29)31/h20,25H,4-19H2,1-3H3