7-hex-5-enyl-3-methyl-1-propyl-purine-2,6-dione

Systemtic Name: 7-hex-5-enyl-3-methyl-1-propyl-purine-2,6-dione Openeye Name: 7-hex-5-enyl-3-methyl-1-propyl-purine-2,6-dione CAS Name: 7-hex-5-enyl-3-methyl-1-propylpurine-2,6-dione IUPAC Name: 7-hex-5-enyl-3-methyl-1-propylpurine-2,6-dione Traditional Name: 7-hex-5-enyl-3-methyl-1-propyl-xanthine Formula: C15H22N4O2 MolecularWeight: 290.36078

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=CN2CCCCC=C)N(C1=O)C

Isomeric SMILES

CCCN1C(=O)C2=C(N=CN2CCCCC=C)N(C1=O)C

InChI

InChI=1S/C15H22N4O2/c1-4-6-7-8-10-18-11-16-13-12(18)14(20)19(9-5-2)15(21)17(13)3/h4,11H,1,5-10H2,2-3H3