7-(2,2-dimethylpropanoyl)-3-methyl-1-undec-10-enyl-purine-2,6-dione

Systemtic Name: 7-(2,2-dimethylpropanoyl)-3-methyl-1-undec-10-enyl-purine-2,6-dione Openeye Name: 7-(2,2-dimethylpropanoyl)-3-methyl-1-undec-10-enyl-purine-2,6-dione CAS Name: 7-(2,2-dimethyl-1-oxopropyl)-3-methyl-1-undec-10-enylpurine-2,6-dione IUPAC Name: 7-(2,2-dimethylpropanoyl)-3-methyl-1-undec-10-enylpurine-2,6-dione Traditional Name: 3-methyl-7-pivaloyl-1-undec-10-enyl-xanthine Formula: C22H34N4O3 MolecularWeight: 402.53036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCC=C

Isomeric SMILES

CC(C)(C)C(=O)N1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCC=C

InChI

InChI=1S/C22H34N4O3/c1-6-7-8-9-10-11-12-13-14-15-25-19(27)17-18(24(5)21(25)29)23-16-26(17)20(28)22(2,3)4/h6,16H,1,7-15H2,2-5H3