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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)N3C(=O)C(=C(N(C3=N2)CC4=CC=C(C=C4)OC)O)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)N3C(=O)C(=C(N(C3=N2)CC4=CC=C(C=C4)OC)O)C

InChI

InChI=1S/C23H27N5O5/c1-5-11-25-18-17(21(31)26(12-6-2)23(25)32)28-20(30)14(3)19(29)27(22(28)24-18)13-15-7-9-16(33-4)10-8-15/h7-10,29H,5-6,11-13H2,1-4H3