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

Systemtic Name: 1,3-dibutyl-9-[(4-methoxyphenyl)methyl]-8-oxidanyl-7-propyl-purino[7,8-a]pyrimidine-2,4,6-trione Openeye Name: 1,3-dibutyl-8-hydroxy-9-[(4-methoxyphenyl)methyl]-7-propyl-purino[7,8-a]pyrimidine-2,4,6-trione CAS Name: 1,3-dibutyl-8-hydroxy-9-[(4-methoxyphenyl)methyl]-7-propylpurino[7,8-a]pyrimidine-2,4,6-trione IUPAC Name: 1,3-dibutyl-8-hydroxy-9-[(4-methoxyphenyl)methyl]-7-propylpurino[7,8-a]pyrimidine-2,4,6-trione Traditional Name: 1,3-dibutyl-8-hydroxy-9-p-anisyl-7-propyl-purino[7,8-a]pyrimidine-2,4,6-trione Formula: C27H35N5O5 MolecularWeight: 509.5973

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CCCC)N3C(=O)C(=C(N(C3=N2)CC4=CC=C(C=C4)OC)O)CCC

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CCCC)N3C(=O)C(=C(N(C3=N2)CC4=CC=C(C=C4)OC)O)CCC

InChI

InChI=1S/C27H35N5O5/c1-5-8-15-29-22-21(25(35)30(27(29)36)16-9-6-2)32-24(34)20(10-7-3)23(33)31(26(32)28-22)17-18-11-13-19(37-4)14-12-18/h11-14,33H,5-10,15-17H2,1-4H3