methyl 6-(2-phenylethynyl)pyridine-3-carboxylate

Systemtic Name: methyl 6-(2-phenylethynyl)pyridine-3-carboxylate Openeye Name: methyl 6-(2-phenylethynyl)pyridine-3-carboxylate CAS Name: 6-(2-phenylethynyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(2-phenylethynyl)pyridine-3-carboxylate Traditional Name: 6-(2-phenylethynyl)nicotinic acid methyl ester Formula: C15H11NO2 MolecularWeight: 237.25334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C#CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C#CC2=CC=CC=C2

InChI

InChI=1S/C15H11NO2/c1-18-15(17)13-8-10-14(16-11-13)9-7-12-5-3-2-4-6-12/h2-6,8,10-11H,1H3