5-(5-ethynylpyridin-3-yl)-1-methyl-pyrrolidin-2-one

Systemtic Name: 5-(5-ethynylpyridin-3-yl)-1-methyl-pyrrolidin-2-one Openeye Name: 5-(5-ethynyl-3-pyridyl)-1-methyl-pyrrolidin-2-one CAS Name: 5-(5-ethynyl-3-pyridinyl)-1-methyl-2-pyrrolidinone IUPAC Name: 5-(5-ethynylpyridin-3-yl)-1-methylpyrrolidin-2-one Traditional Name: 5-(5-ethynyl-3-pyridyl)-1-methyl-2-pyrrolidone Formula: C12H12N2O MolecularWeight: 200.23648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CCC1=O)C2=CN=CC(=C2)C#C

Isomeric SMILES

CN1C(CCC1=O)C2=CN=CC(=C2)C#C

InChI

InChI=1S/C12H12N2O/c1-3-9-6-10(8-13-7-9)11-4-5-12(15)14(11)2/h1,6-8,11H,4-5H2,2H3