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3-butyl-7-ethyl-8-methyl-1-prop-2-enyl-purine-2,6-dione

3-butyl-7-ethyl-8-methyl-1-prop-2-enyl-purine-2,6-dione

Systemtic Name:3-butyl-7-ethyl-8-methyl-1-prop-2-enyl-purine-2,6-dione
Openeye Name:1-allyl-3-butyl-7-ethyl-8-methyl-purine-2,6-dione
CAS Name:3-butyl-7-ethyl-8-methyl-1-prop-2-enylpurine-2,6-dione
IUPAC Name:3-butyl-7-ethyl-8-methyl-1-prop-2-enylpurine-2,6-dione
Traditional Name:1-allyl-3-butyl-7-ethyl-8-methyl-xanthine
Formula: C15H22N4O2
MolecularWeight: 290.36078
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CC=C)N(C(=N2)C)CC


Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CC=C)N(C(=N2)C)CC


InChI

InChI=1S/C15H22N4O2/c1-5-8-10-18-13-12(17(7-3)11(4)16-13)14(20)19(9-6-2)15(18)21/h6H,2,5,7-10H2,1,3-4H3


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