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

Systemtic Name: 1,3-dimethyl-8-oxidanyl-9-(phenylmethyl)-2H-purino[7,8-a]pyrimidine-4,6-dione Openeye Name: 9-benzyl-8-hydroxy-1,3-dimethyl-2H-purino[7,8-a]pyrimidine-4,6-dione CAS Name: 8-hydroxy-1,3-dimethyl-9-(phenylmethyl)-2H-purino[7,8-a]pyrimidine-4,6-dione IUPAC Name: 9-benzyl-8-hydroxy-1,3-dimethyl-2H-purino[7,8-a]pyrimidine-4,6-dione Traditional Name: 9-benzyl-8-hydroxy-1,3-dimethyl-2H-purino[7,8-a]pyrimidine-4,6-quinone Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CN1CN(C(=O)C2=C1N=C3N2C(=O)C=C(N3CC4=CC=CC=C4)O)C

Isomeric SMILES

CN1CN(C(=O)C2=C1N=C3N2C(=O)C=C(N3CC4=CC=CC=C4)O)C

InChI

InChI=1S/C17H17N5O3/c1-19-10-20(2)16(25)14-15(19)18-17-21(9-11-6-4-3-5-7-11)12(23)8-13(24)22(14)17/h3-8,23H,9-10H2,1-2H3