3-methyl-8-(4-oxidanylbutylamino)-1-(5-oxidanylhexyl)-7H-purine-2,6-dione

Systemtic Name: 3-methyl-8-(4-oxidanylbutylamino)-1-(5-oxidanylhexyl)-7H-purine-2,6-dione Openeye Name: 8-(4-hydroxybutylamino)-1-(5-hydroxyhexyl)-3-methyl-7H-purine-2,6-dione CAS Name: 8-(4-hydroxybutylamino)-1-(5-hydroxyhexyl)-3-methyl-7H-purine-2,6-dione IUPAC Name: 8-(4-hydroxybutylamino)-1-(5-hydroxyhexyl)-3-methyl-7H-purine-2,6-dione Traditional Name: 8-(4-hydroxybutylamino)-1-(5-hydroxyhexyl)-3-methyl-7H-purine-2,6-quinone Formula: C16H27N5O4 MolecularWeight: 353.41668

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN1C(=O)C2=C(N=C(N2)NCCCCO)N(C1=O)C)O

Isomeric SMILES

CC(CCCCN1C(=O)C2=C(N=C(N2)NCCCCO)N(C1=O)C)O

InChI

InChI=1S/C16H27N5O4/c1-11(23)7-3-5-9-21-14(24)12-13(20(2)16(21)25)19-15(18-12)17-8-4-6-10-22/h11,22-23H,3-10H2,1-2H3,(H2,17,18,19)