5-[2-(3,5-dimethylphenyl)ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one

Systemtic Name: 5-[2-(3,5-dimethylphenyl)ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Openeye Name: 5-[2-(3,5-dimethylphenyl)ethynyl]-1-methyl-3-(1-piperidylmethyl)pyrrolidin-2-one CAS Name: 5-[2-(3,5-dimethylphenyl)ethynyl]-1-methyl-3-(1-piperidinylmethyl)-2-pyrrolidinone IUPAC Name: 5-[2-(3,5-dimethylphenyl)ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Traditional Name: 5-[2-(3,5-dimethylphenyl)ethynyl]-1-methyl-3-(piperidinomethyl)-2-pyrrolidone Formula: C21H28N2O MolecularWeight: 324.45982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O/c1-16-11-17(2)13-18(12-16)7-8-20-14-19(21(24)22(20)3)15-23-9-5-4-6-10-23/h11-13,19-20H,4-6,9-10,14-15H2,1-3H3