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

Systemtic Name: 1,3-diethyl-7-hexyl-9-[(4-methoxyphenyl)methyl]-8-oxidanyl-purino[7,8-a]pyrimidine-2,4,6-trione Openeye Name: 1,3-diethyl-7-hexyl-8-hydroxy-9-[(4-methoxyphenyl)methyl]purino[7,8-a]pyrimidine-2,4,6-trione CAS Name: 1,3-diethyl-7-hexyl-8-hydroxy-9-[(4-methoxyphenyl)methyl]purino[7,8-a]pyrimidine-2,4,6-trione IUPAC Name: 1,3-diethyl-7-hexyl-8-hydroxy-9-[(4-methoxyphenyl)methyl]purino[7,8-a]pyrimidine-2,4,6-trione Traditional Name: 1,3-diethyl-7-hexyl-8-hydroxy-9-p-anisyl-purino[7,8-a]pyrimidine-2,4,6-trione Formula: C26H33N5O5 MolecularWeight: 495.57072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(N(C2=NC3=C(N2C1=O)C(=O)N(C(=O)N3CC)CC)CC4=CC=C(C=C4)OC)O

Isomeric SMILES

CCCCCCC1=C(N(C2=NC3=C(N2C1=O)C(=O)N(C(=O)N3CC)CC)CC4=CC=C(C=C4)OC)O

InChI

InChI=1S/C26H33N5O5/c1-5-8-9-10-11-19-22(32)30(16-17-12-14-18(36-4)15-13-17)25-27-21-20(31(25)23(19)33)24(34)29(7-3)26(35)28(21)6-2/h12-15,32H,5-11,16H2,1-4H3