N-(4-hydroxyphenyl)-2-[1-[3-(2-pyridin-2-ylethynyl)phenyl]carbonylpiperidin-4-yl]ethanamide

Systemtic Name: N-(4-hydroxyphenyl)-2-[1-[3-(2-pyridin-2-ylethynyl)phenyl]carbonylpiperidin-4-yl]ethanamide Openeye Name: N-(4-hydroxyphenyl)-2-[1-[3-[2-(2-pyridyl)ethynyl]benzoyl]-4-piperidyl]acetamide CAS Name: N-(4-hydroxyphenyl)-2-[1-[oxo-[3-[2-(2-pyridinyl)ethynyl]phenyl]methyl]-4-piperidinyl]acetamide IUPAC Name: N-(4-hydroxyphenyl)-2-[1-[3-(2-pyridin-2-ylethynyl)benzoyl]piperidin-4-yl]acetamide Traditional Name: N-(4-hydroxyphenyl)-2-[1-[3-[2-(2-pyridyl)ethynyl]benzoyl]-4-piperidyl]acetamide Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(=O)NC2=CC=C(C=C2)O)C(=O)C3=CC=CC(=C3)C#CC4=CC=CC=N4

Isomeric SMILES

C1CN(CCC1CC(=O)NC2=CC=C(C=C2)O)C(=O)C3=CC=CC(=C3)C#CC4=CC=CC=N4

InChI

InChI=1S/C27H25N3O3/c31-25-11-9-24(10-12-25)29-26(32)19-21-13-16-30(17-14-21)27(33)22-5-3-4-20(18-22)7-8-23-6-1-2-15-28-23/h1-6,9-12,15,18,21,31H,13-14,16-17,19H2,(H,29,32)