[6-(5-methyl-2-propan-2-yl-phenoxy)pyridin-3-yl]methylazanium

Systemtic Name: [6-(5-methyl-2-propan-2-yl-phenoxy)pyridin-3-yl]methylazanium Openeye Name: [6-(2-isopropyl-5-methyl-phenoxy)-3-pyridyl]methylammonium CAS Name: [6-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methylammonium IUPAC Name: [6-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-yl]methylazanium Traditional Name: [6-(2-isopropyl-5-methyl-phenoxy)-3-pyridyl]methylammonium Formula: C16H21N2O+ MolecularWeight: 257.35074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC2=NC=C(C=C2)C[NH3+]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC2=NC=C(C=C2)C[NH3+]

InChI

InChI=1S/C16H20N2O/c1-11(2)14-6-4-12(3)8-15(14)19-16-7-5-13(9-17)10-18-16/h4-8,10-11H,9,17H2,1-3H3/p+1