4,7-dimethyl-2-(2-oxidanylidenepropyl)-6-propyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7-dimethyl-2-(2-oxidanylidenepropyl)-6-propyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-acetonyl-4,7-dimethyl-6-propyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-2-(2-oxopropyl)-6-propylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-2-(2-oxopropyl)-6-propylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-acetonyl-4,7-dimethyl-6-propyl-purin[7,8-a]imidazole-1,3-quinone Formula: C15H19N5O3 MolecularWeight: 317.34306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC(=O)C)C

Isomeric SMILES

CCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC(=O)C)C

InChI

InChI=1S/C15H19N5O3/c1-5-6-18-9(2)7-19-11-12(16-14(18)19)17(4)15(23)20(13(11)22)8-10(3)21/h7H,5-6,8H2,1-4H3