ethyl 5-hex-1-ynylpyridine-3-carboxylate

Systemtic Name: ethyl 5-hex-1-ynylpyridine-3-carboxylate Openeye Name: ethyl 5-hex-1-ynylpyridine-3-carboxylate CAS Name: 5-hex-1-ynyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-hex-1-ynylpyridine-3-carboxylate Traditional Name: 5-hex-1-ynylnicotinic acid ethyl ester Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC(=CN=C1)C(=O)OCC

Isomeric SMILES

CCCCC#CC1=CC(=CN=C1)C(=O)OCC

InChI

InChI=1S/C14H17NO2/c1-3-5-6-7-8-12-9-13(11-15-10-12)14(16)17-4-2/h9-11H,3-6H2,1-2H3