3-methyl-8-(3-oxidanylpropylamino)-7-pentyl-purine-2,6-dione

Systemtic Name: 3-methyl-8-(3-oxidanylpropylamino)-7-pentyl-purine-2,6-dione Openeye Name: 8-(3-hydroxypropylamino)-3-methyl-7-pentyl-purine-2,6-dione CAS Name: 8-(3-hydroxypropylamino)-3-methyl-7-pentylpurine-2,6-dione IUPAC Name: 8-(3-hydroxypropylamino)-3-methyl-7-pentylpurine-2,6-dione Traditional Name: 7-amyl-8-(3-hydroxypropylamino)-3-methyl-xanthine Formula: C14H23N5O3 MolecularWeight: 309.36412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(N=C1NCCCO)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCN1C2=C(N=C1NCCCO)N(C(=O)NC2=O)C

InChI

InChI=1S/C14H23N5O3/c1-3-4-5-8-19-10-11(16-13(19)15-7-6-9-20)18(2)14(22)17-12(10)21/h20H,3-9H2,1-2H3,(H,15,16)(H,17,21,22)