1-methyl-5-[2-(4-methylphenyl)ethynyl]-3-(piperidin-1-ylmethyl)pyrrolidin-2-one

Systemtic Name: 1-methyl-5-[2-(4-methylphenyl)ethynyl]-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Openeye Name: 1-methyl-3-(1-piperidylmethyl)-5-[2-(p-tolyl)ethynyl]pyrrolidin-2-one CAS Name: 1-methyl-5-[2-(4-methylphenyl)ethynyl]-3-(1-piperidinylmethyl)-2-pyrrolidinone IUPAC Name: 1-methyl-5-[2-(4-methylphenyl)ethynyl]-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Traditional Name: 1-methyl-3-(piperidinomethyl)-5-[2-(p-tolyl)ethynyl]-2-pyrrolidone Formula: C20H26N2O MolecularWeight: 310.43324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2CC(C(=O)N2C)CN3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2CC(C(=O)N2C)CN3CCCCC3

InChI

InChI=1S/C20H26N2O/c1-16-6-8-17(9-7-16)10-11-19-14-18(20(23)21(19)2)15-22-12-4-3-5-13-22/h6-9,18-19H,3-5,12-15H2,1-2H3