N-(pyridin-4-ylmethyl)-2-[2,4,6-tris(chloranyl)phenoxy]ethanamine

Systemtic Name: N-(pyridin-4-ylmethyl)-2-[2,4,6-tris(chloranyl)phenoxy]ethanamine Openeye Name: N-(4-pyridylmethyl)-2-(2,4,6-trichlorophenoxy)ethanamine CAS Name: N-(pyridin-4-ylmethyl)-2-(2,4,6-trichlorophenoxy)ethanamine IUPAC Name: N-(pyridin-4-ylmethyl)-2-(2,4,6-trichlorophenoxy)ethanamine Traditional Name: 4-pyridylmethyl-[2-(2,4,6-trichlorophenoxy)ethyl]amine Formula: C14H13Cl3N2O MolecularWeight: 331.62482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CNCCOC2=C(C=C(C=C2Cl)Cl)Cl

Isomeric SMILES

C1=CN=CC=C1CNCCOC2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C14H13Cl3N2O/c15-11-7-12(16)14(13(17)8-11)20-6-5-19-9-10-1-3-18-4-2-10/h1-4,7-8,19H,5-6,9H2