8-methyl-1-prop-2-enyl-3-propyl-7H-purine-2,6-dione

Systemtic Name: 8-methyl-1-prop-2-enyl-3-propyl-7H-purine-2,6-dione Openeye Name: 1-allyl-8-methyl-3-propyl-7H-purine-2,6-dione CAS Name: 8-methyl-1-prop-2-enyl-3-propyl-7H-purine-2,6-dione IUPAC Name: 8-methyl-1-prop-2-enyl-3-propyl-7H-purine-2,6-dione Traditional Name: 1-allyl-8-methyl-3-propyl-7H-purine-2,6-quinone Formula: C12H16N4O2 MolecularWeight: 248.28104

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CC=C)NC(=N2)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CC=C)NC(=N2)C

InChI

InChI=1S/C12H16N4O2/c1-4-6-15-10-9(13-8(3)14-10)11(17)16(7-5-2)12(15)18/h5H,2,4,6-7H2,1,3H3,(H,13,14)