5-ethynyl-1-octyl-pyrimidine-2,4-dione

Systemtic Name: 5-ethynyl-1-octyl-pyrimidine-2,4-dione Openeye Name: 5-ethynyl-1-octyl-pyrimidine-2,4-dione CAS Name: 5-ethynyl-1-octylpyrimidine-2,4-dione IUPAC Name: 5-ethynyl-1-octylpyrimidine-2,4-dione Traditional Name: 5-ethynyl-1-octyl-pyrimidine-2,4-quinone Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C=C(C(=O)NC1=O)C#C

Isomeric SMILES

CCCCCCCCN1C=C(C(=O)NC1=O)C#C

InChI

InChI=1S/C14H20N2O2/c1-3-5-6-7-8-9-10-16-11-12(4-2)13(17)15-14(16)18/h2,11H,3,5-10H2,1H3,(H,15,17,18)