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

Systemtic Name: 9-(3-methoxyphenyl)-1-methyl-7-oxidanyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione Openeye Name: 7-hydroxy-9-(3-methoxyphenyl)-1-methyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione CAS Name: 7-hydroxy-9-(3-methoxyphenyl)-1-methyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione IUPAC Name: 7-hydroxy-9-(3-methoxyphenyl)-1-methyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione Traditional Name: 7-hydroxy-9-(3-methoxyphenyl)-1-methyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-quinone Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N3CC(CN(C3=N2)C4=CC(=CC=C4)OC)O

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N3CC(CN(C3=N2)C4=CC(=CC=C4)OC)O

InChI

InChI=1S/C16H17N5O4/c1-19-13-12(14(23)18-16(19)24)21-8-10(22)7-20(15(21)17-13)9-4-3-5-11(6-9)25-2/h3-6,10,22H,7-8H2,1-2H3,(H,18,23,24)