(3R,5S)-1-methyl-5-(2-phenylethynyl)-3-(piperidin-1-ylmethyl)pyrrolidin-2-one

Systemtic Name: (3R,5S)-1-methyl-5-(2-phenylethynyl)-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Openeye Name: (3R,5S)-1-methyl-5-(2-phenylethynyl)-3-(1-piperidylmethyl)pyrrolidin-2-one CAS Name: (3R,5S)-1-methyl-5-(2-phenylethynyl)-3-(1-piperidinylmethyl)-2-pyrrolidinone IUPAC Name: (3R,5S)-1-methyl-5-(2-phenylethynyl)-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Traditional Name: (3R,5S)-1-methyl-5-(2-phenylethynyl)-3-(piperidinomethyl)-2-pyrrolidone Formula: C19H24N2O MolecularWeight: 296.40666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN1[C@@H](C[C@@H](C1=O)CN2CCCCC2)C#CC3=CC=CC=C3

InChI

InChI=1S/C19H24N2O/c1-20-18(11-10-16-8-4-2-5-9-16)14-17(19(20)22)15-21-12-6-3-7-13-21/h2,4-5,8-9,17-18H,3,6-7,12-15H2,1H3/t17-,18-/m1/s1