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

Systemtic Name: 8-oxidanyl-9-(phenylmethyl)-1,3-dipropyl-purino[7,8-a]pyrimidine-2,4,6-trione Openeye Name: 9-benzyl-8-hydroxy-1,3-dipropyl-purino[7,8-a]pyrimidine-2,4,6-trione CAS Name: 8-hydroxy-9-(phenylmethyl)-1,3-dipropylpurino[7,8-a]pyrimidine-2,4,6-trione IUPAC Name: 9-benzyl-8-hydroxy-1,3-dipropylpurino[7,8-a]pyrimidine-2,4,6-trione Traditional Name: 9-benzyl-8-hydroxy-1,3-dipropyl-purino[7,8-a]pyrimidine-2,4,6-trione Formula: C21H23N5O4 MolecularWeight: 409.43842

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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=CC=C4)O

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5O4/c1-3-10-23-18-17(19(29)24(11-4-2)21(23)30)26-16(28)12-15(27)25(20(26)22-18)13-14-8-6-5-7-9-14/h5-9,12,27H,3-4,10-11,13H2,1-2H3