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

Systemtic Name: 5-[2-(3-aminophenyl)ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Openeye Name: 5-[2-(3-aminophenyl)ethynyl]-1-methyl-3-(1-piperidylmethyl)pyrrolidin-2-one CAS Name: 5-[2-(3-aminophenyl)ethynyl]-1-methyl-3-(1-piperidinylmethyl)-2-pyrrolidinone IUPAC Name: 5-[2-(3-aminophenyl)ethynyl]-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one Traditional Name: 5-[2-(3-aminophenyl)ethynyl]-1-methyl-3-(piperidinomethyl)-2-pyrrolidone Formula: C19H25N3O MolecularWeight: 311.4213

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O/c1-21-18(9-8-15-6-5-7-17(20)12-15)13-16(19(21)23)14-22-10-3-2-4-11-22/h5-7,12,16,18H,2-4,10-11,13-14,20H2,1H3