ethyl 6-hex-1-ynyl-2-methyl-pyrimidine-4-carboxylate

Systemtic Name: ethyl 6-hex-1-ynyl-2-methyl-pyrimidine-4-carboxylate Openeye Name: ethyl 6-hex-1-ynyl-2-methyl-pyrimidine-4-carboxylate CAS Name: 6-hex-1-ynyl-2-methyl-4-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-hex-1-ynyl-2-methylpyrimidine-4-carboxylate Traditional Name: 6-hex-1-ynyl-2-methyl-pyrimidine-4-carboxylic acid ethyl ester Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC(=NC(=N1)C)C(=O)OCC

Isomeric SMILES

CCCCC#CC1=CC(=NC(=N1)C)C(=O)OCC

InChI

InChI=1S/C14H18N2O2/c1-4-6-7-8-9-12-10-13(14(17)18-5-2)16-11(3)15-12/h10H,4-7H2,1-3H3