3-[3-(2-pyridin-2-ylethynyl)phenyl]propan-1-amine

Systemtic Name: 3-[3-(2-pyridin-2-ylethynyl)phenyl]propan-1-amine Openeye Name: 3-[3-[2-(2-pyridyl)ethynyl]phenyl]propan-1-amine CAS Name: 3-[3-[2-(2-pyridinyl)ethynyl]phenyl]-1-propanamine IUPAC Name: 3-[3-(2-pyridin-2-ylethynyl)phenyl]propan-1-amine Traditional Name: 3-[3-[2-(2-pyridyl)ethynyl]phenyl]propylamine Formula: C16H16N2 MolecularWeight: 236.31164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C#CC2=CC(=CC=C2)CCCN

Isomeric SMILES

C1=CC=NC(=C1)C#CC2=CC(=CC=C2)CCCN

InChI

InChI=1S/C16H16N2/c17-11-4-7-14-5-3-6-15(13-14)9-10-16-8-1-2-12-18-16/h1-3,5-6,8,12-13H,4,7,11,17H2