[3-[2-(2-pyridin-2-ylethoxy)ethanoylamino]phenyl]methylazanium

Systemtic Name: [3-[2-(2-pyridin-2-ylethoxy)ethanoylamino]phenyl]methylazanium Openeye Name: [3-[[2-[2-(2-pyridyl)ethoxy]acetyl]amino]phenyl]methylammonium CAS Name: [3-[[1-oxo-2-[2-(2-pyridinyl)ethoxy]ethyl]amino]phenyl]methylammonium IUPAC Name: [3-[[2-(2-pyridin-2-ylethoxy)acetyl]amino]phenyl]methylazanium Traditional Name: [3-[[2-[2-(2-pyridyl)ethoxy]acetyl]amino]benzyl]ammonium Formula: C16H20N3O2+ MolecularWeight: 286.3489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCOCC(=O)NC2=CC=CC(=C2)C[NH3+]

Isomeric SMILES

C1=CC=NC(=C1)CCOCC(=O)NC2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C16H19N3O2/c17-11-13-4-3-6-15(10-13)19-16(20)12-21-9-7-14-5-1-2-8-18-14/h1-6,8,10H,7,9,11-12,17H2,(H,19,20)/p+1