3-ethyl-1-prop-1-ynyl-7H-purine-2,6-dione

Systemtic Name: 3-ethyl-1-prop-1-ynyl-7H-purine-2,6-dione Openeye Name: 3-ethyl-1-prop-1-ynyl-7H-purine-2,6-dione CAS Name: 3-ethyl-1-prop-1-ynyl-7H-purine-2,6-dione IUPAC Name: 3-ethyl-1-prop-1-ynyl-7H-purine-2,6-dione Traditional Name: 3-ethyl-1-prop-1-ynyl-7H-purine-2,6-quinone Formula: C10H10N4O2 MolecularWeight: 218.212

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C1=O)C#CC)NC=N2

Isomeric SMILES

CCN1C2=C(C(=O)N(C1=O)C#CC)NC=N2

InChI

InChI=1S/C10H10N4O2/c1-3-5-14-9(15)7-8(12-6-11-7)13(4-2)10(14)16/h6H,4H2,1-2H3,(H,11,12)