tert-butyl-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium

Systemtic Name: tert-butyl-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium Openeye Name: tert-butyl-[[3-ethoxy-4-(2-thienylmethoxy)phenyl]methyl]ammonium CAS Name: tert-butyl-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]ammonium IUPAC Name: tert-butyl-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium Traditional Name: tert-butyl-[3-ethoxy-4-(2-thenyloxy)benzyl]ammonium Formula: C18H26NO2S+ MolecularWeight: 320.46954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C(C)(C)C)OCC2=CC=CS2

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]C(C)(C)C)OCC2=CC=CS2

InChI

InChI=1S/C18H25NO2S/c1-5-20-17-11-14(12-19-18(2,3)4)8-9-16(17)21-13-15-7-6-10-22-15/h6-11,19H,5,12-13H2,1-4H3/p+1