(3R,5S)-5-[2-(1-benzofuran-5-yl)ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one

Systemtic Name: (3R,5S)-5-[2-(1-benzofuran-5-yl)ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Openeye Name: (3R,5S)-5-[2-(benzofuran-5-yl)ethynyl]-1-methyl-3-(1-piperidylmethyl)pyrrolidin-2-one CAS Name: (3R,5S)-5-[2-(5-benzofuranyl)ethynyl]-1-methyl-3-(1-piperidinylmethyl)-2-pyrrolidinone IUPAC Name: (3R,5S)-5-[2-(1-benzofuran-5-yl)ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Traditional Name: (3R,5S)-5-[2-(benzofuran-5-yl)ethynyl]-1-methyl-3-(piperidinomethyl)-2-pyrrolidone Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC(C1=O)CN2CCCCC2)C#CC3=CC4=C(C=C3)OC=C4

Isomeric SMILES

CN1[C@@H](C[C@@H](C1=O)CN2CCCCC2)C#CC3=CC4=C(C=C3)OC=C4

InChI

InChI=1S/C21H24N2O2/c1-22-19(7-5-16-6-8-20-17(13-16)9-12-25-20)14-18(21(22)24)15-23-10-3-2-4-11-23/h6,8-9,12-13,18-19H,2-4,10-11,14-15H2,1H3/t18-,19-/m1/s1