4-ethyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide

Systemtic Name: 4-ethyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Openeye Name: 4-ethyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide CAS Name: 4-ethyl-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]benzamide IUPAC Name: 4-ethyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Traditional Name: 4-ethyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide Formula: C22H18N2O MolecularWeight: 326.39112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3

InChI

InChI=1S/C22H18N2O/c1-2-17-9-12-19(13-10-17)22(25)24-21-8-5-6-18(16-21)11-14-20-7-3-4-15-23-20/h3-10,12-13,15-16H,2H2,1H3,(H,24,25)