[(E)-3-methylpent-2-en-4-ynyl] 1,4,5,6-tetrahydropyrimidine-5-carboxylate

Systemtic Name: [(E)-3-methylpent-2-en-4-ynyl] 1,4,5,6-tetrahydropyrimidine-5-carboxylate Openeye Name: [(E)-3-methylpent-2-en-4-ynyl] 1,4,5,6-tetrahydropyrimidine-5-carboxylate CAS Name: 1,4,5,6-tetrahydropyrimidine-5-carboxylic acid [(E)-3-methylpent-2-en-4-ynyl] ester IUPAC Name: [(E)-3-methylpent-2-en-4-ynyl] 1,4,5,6-tetrahydropyrimidine-5-carboxylate Traditional Name: 1,4,5,6-tetrahydropyrimidine-5-carboxylic acid [(E)-3-methylpent-2-en-4-ynyl] ester Formula: C11H14N2O2 MolecularWeight: 206.24106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C1CNC=NC1)C#C

Isomeric SMILES

C/C(=C\COC(=O)C1CNC=NC1)/C#C

InChI

InChI=1S/C11H14N2O2/c1-3-9(2)4-5-15-11(14)10-6-12-8-13-7-10/h1,4,8,10H,5-7H2,2H3,(H,12,13)/b9-4+