9-[(4-methoxyphenyl)methyl]-1,3-dimethyl-8-oxidanyl-7-pentyl-purino[7,8-a]pyrimidine-2,4,6-trione

Systemtic Name: 9-[(4-methoxyphenyl)methyl]-1,3-dimethyl-8-oxidanyl-7-pentyl-purino[7,8-a]pyrimidine-2,4,6-trione Openeye Name: 8-hydroxy-9-[(4-methoxyphenyl)methyl]-1,3-dimethyl-7-pentyl-purino[7,8-a]pyrimidine-2,4,6-trione CAS Name: 8-hydroxy-9-[(4-methoxyphenyl)methyl]-1,3-dimethyl-7-pentylpurino[7,8-a]pyrimidine-2,4,6-trione IUPAC Name: 8-hydroxy-9-[(4-methoxyphenyl)methyl]-1,3-dimethyl-7-pentylpurino[7,8-a]pyrimidine-2,4,6-trione Traditional Name: 7-amyl-8-hydroxy-1,3-dimethyl-9-p-anisyl-purino[7,8-a]pyrimidine-2,4,6-trione Formula: C23H27N5O5 MolecularWeight: 453.49098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(N(C2=NC3=C(N2C1=O)C(=O)N(C(=O)N3C)C)CC4=CC=C(C=C4)OC)O

Isomeric SMILES

CCCCCC1=C(N(C2=NC3=C(N2C1=O)C(=O)N(C(=O)N3C)C)CC4=CC=C(C=C4)OC)O

InChI

InChI=1S/C23H27N5O5/c1-5-6-7-8-16-19(29)27(13-14-9-11-15(33-4)12-10-14)22-24-18-17(28(22)20(16)30)21(31)26(3)23(32)25(18)2/h9-12,29H,5-8,13H2,1-4H3