8-(3-methoxypropylamino)-3-methyl-7-octyl-purine-2,6-dione

Systemtic Name: 8-(3-methoxypropylamino)-3-methyl-7-octyl-purine-2,6-dione Openeye Name: 8-(3-methoxypropylamino)-3-methyl-7-octyl-purine-2,6-dione CAS Name: 8-(3-methoxypropylamino)-3-methyl-7-octylpurine-2,6-dione IUPAC Name: 8-(3-methoxypropylamino)-3-methyl-7-octylpurine-2,6-dione Traditional Name: 8-(3-methoxypropylamino)-3-methyl-7-octyl-xanthine Formula: C18H31N5O3 MolecularWeight: 365.47044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(N=C1NCCCOC)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCN1C2=C(N=C1NCCCOC)N(C(=O)NC2=O)C

InChI

InChI=1S/C18H31N5O3/c1-4-5-6-7-8-9-12-23-14-15(22(2)18(25)21-16(14)24)20-17(23)19-11-10-13-26-3/h4-13H2,1-3H3,(H,19,20)(H,21,24,25)