3,7-diethyl-1-[(E)-hex-4-enyl]purine-2,6-dione

Systemtic Name: 3,7-diethyl-1-[(E)-hex-4-enyl]purine-2,6-dione Openeye Name: 3,7-diethyl-1-[(E)-hex-4-enyl]purine-2,6-dione CAS Name: 3,7-diethyl-1-[(E)-hex-4-enyl]purine-2,6-dione IUPAC Name: 3,7-diethyl-1-[(E)-hex-4-enyl]purine-2,6-dione Traditional Name: 3,7-diethyl-1-[(E)-hex-4-enyl]xanthine Formula: C15H22N4O2 MolecularWeight: 290.36078

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1C(=O)N(C(=O)N2CC)CCCC=CC

Isomeric SMILES

CCN1C=NC2=C1C(=O)N(C(=O)N2CC)CCC/C=C/C

InChI

InChI=1S/C15H22N4O2/c1-4-7-8-9-10-19-14(20)12-13(16-11-17(12)5-2)18(6-3)15(19)21/h4,7,11H,5-6,8-10H2,1-3H3/b7-4+