[6-(2-tert-butyl-4-ethyl-phenoxy)pyridin-3-yl]methylazanium

Systemtic Name: [6-(2-tert-butyl-4-ethyl-phenoxy)pyridin-3-yl]methylazanium Openeye Name: [6-(2-tert-butyl-4-ethyl-phenoxy)-3-pyridyl]methylammonium CAS Name: [6-(2-tert-butyl-4-ethylphenoxy)-3-pyridinyl]methylammonium IUPAC Name: [6-(2-tert-butyl-4-ethylphenoxy)pyridin-3-yl]methylazanium Traditional Name: [6-(2-tert-butyl-4-ethyl-phenoxy)-3-pyridyl]methylammonium Formula: C18H25N2O+ MolecularWeight: 285.4039

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC2=NC=C(C=C2)C[NH3+])C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)OC2=NC=C(C=C2)C[NH3+])C(C)(C)C

InChI

InChI=1S/C18H24N2O/c1-5-13-6-8-16(15(10-13)18(2,3)4)21-17-9-7-14(11-19)12-20-17/h6-10,12H,5,11,19H2,1-4H3/p+1