methyl 2-hex-1-ynyl-3-methanoyl-2H-pyridine-1-carboxylate

Systemtic Name: methyl 2-hex-1-ynyl-3-methanoyl-2H-pyridine-1-carboxylate Openeye Name: methyl 3-formyl-2-hex-1-ynyl-2H-pyridine-1-carboxylate CAS Name: 3-formyl-2-hex-1-ynyl-2H-pyridine-1-carboxylic acid methyl ester IUPAC Name: methyl 3-formyl-2-hex-1-ynyl-2H-pyridine-1-carboxylate Traditional Name: 3-formyl-2-hex-1-ynyl-2H-pyridine-1-carboxylic acid methyl ester Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1C(=CC=CN1C(=O)OC)C=O

Isomeric SMILES

CCCCC#CC1C(=CC=CN1C(=O)OC)C=O

InChI

InChI=1S/C14H17NO3/c1-3-4-5-6-9-13-12(11-16)8-7-10-15(13)14(17)18-2/h7-8,10-11,13H,3-5H2,1-2H3