1,3,7-trimethyl-8-oxidanyl-9-phenethyl-purino[7,8-a]pyrimidine-2,4,6-trione

Systemtic Name: 1,3,7-trimethyl-8-oxidanyl-9-phenethyl-purino[7,8-a]pyrimidine-2,4,6-trione Openeye Name: 8-hydroxy-1,3,7-trimethyl-9-phenethyl-purino[7,8-a]pyrimidine-2,4,6-trione CAS Name: 8-hydroxy-1,3,7-trimethyl-9-phenethylpurino[7,8-a]pyrimidine-2,4,6-trione IUPAC Name: 8-hydroxy-1,3,7-trimethyl-9-phenethylpurino[7,8-a]pyrimidine-2,4,6-trione Traditional Name: 8-hydroxy-1,3,7-trimethyl-9-phenethyl-purino[7,8-a]pyrimidine-2,4,6-trione Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=NC3=C(N2C1=O)C(=O)N(C(=O)N3C)C)CCC4=CC=CC=C4)O

Isomeric SMILES

CC1=C(N(C2=NC3=C(N2C1=O)C(=O)N(C(=O)N3C)C)CCC4=CC=CC=C4)O

InChI

InChI=1S/C19H19N5O4/c1-11-15(25)23(10-9-12-7-5-4-6-8-12)18-20-14-13(24(18)16(11)26)17(27)22(3)19(28)21(14)2/h4-8,25H,9-10H2,1-3H3