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

Systemtic Name: 3-butyl-8-ethyl-1-prop-2-enyl-7H-purine-2,6-dione Openeye Name: 1-allyl-3-butyl-8-ethyl-7H-purine-2,6-dione CAS Name: 3-butyl-8-ethyl-1-prop-2-enyl-7H-purine-2,6-dione IUPAC Name: 3-butyl-8-ethyl-1-prop-2-enyl-7H-purine-2,6-dione Traditional Name: 1-allyl-3-butyl-8-ethyl-7H-purine-2,6-quinone Formula: C14H20N4O2 MolecularWeight: 276.3342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O2/c1-4-7-9-17-12-11(15-10(6-3)16-12)13(19)18(8-5-2)14(17)20/h5H,2,4,6-9H2,1,3H3,(H,15,16)