1-[6-[3-[2-(2-methoxyphenyl)ethynyl]phenyl]hex-5-ynyl]piperidin-2-one

Systemtic Name: 1-[6-[3-[2-(2-methoxyphenyl)ethynyl]phenyl]hex-5-ynyl]piperidin-2-one Openeye Name: 1-[6-[3-[2-(2-methoxyphenyl)ethynyl]phenyl]hex-5-ynyl]piperidin-2-one CAS Name: 1-[6-[3-[2-(2-methoxyphenyl)ethynyl]phenyl]hex-5-ynyl]-2-piperidinone IUPAC Name: 1-[6-[3-[2-(2-methoxyphenyl)ethynyl]phenyl]hex-5-ynyl]piperidin-2-one Traditional Name: 1-[6-[3-[2-(2-methoxyphenyl)ethynyl]phenyl]hex-5-ynyl]-2-piperidone Formula: C26H27NO2 MolecularWeight: 385.49808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C#CC2=CC(=CC=C2)C#CCCCCN3CCCCC3=O

Isomeric SMILES

COC1=CC=CC=C1C#CC2=CC(=CC=C2)C#CCCCCN3CCCCC3=O

InChI

InChI=1S/C26H27NO2/c1-29-25-15-6-5-14-24(25)18-17-23-13-10-12-22(21-23)11-4-2-3-8-19-27-20-9-7-16-26(27)28/h5-6,10,12-15,21H,2-3,7-9,16,19-20H2,1H3