5-[2-[3-(dimethylamino)phenyl]ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one

Systemtic Name: 5-[2-[3-(dimethylamino)phenyl]ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Openeye Name: 5-[2-[3-(dimethylamino)phenyl]ethynyl]-1-methyl-3-(1-piperidylmethyl)pyrrolidin-2-one CAS Name: 5-[2-[3-(dimethylamino)phenyl]ethynyl]-1-methyl-3-(1-piperidinylmethyl)-2-pyrrolidinone IUPAC Name: 5-[2-[3-(dimethylamino)phenyl]ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Traditional Name: 5-[2-[3-(dimethylamino)phenyl]ethynyl]-1-methyl-3-(piperidinomethyl)-2-pyrrolidone Formula: C21H29N3O MolecularWeight: 339.47446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O/c1-22(2)19-9-7-8-17(14-19)10-11-20-15-18(21(25)23(20)3)16-24-12-5-4-6-13-24/h7-9,14,18,20H,4-6,12-13,15-16H2,1-3H3