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

Systemtic Name: [3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [3-ethoxy-4-(2-thienylmethoxy)phenyl]methyl-(p-tolylmethyl)ammonium CAS Name: [3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [3-ethoxy-4-(2-thenyloxy)benzyl]-(4-methylbenzyl)ammonium Formula: C22H26NO2S+ MolecularWeight: 368.51234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CC2=CC=C(C=C2)C)OCC3=CC=CS3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CC2=CC=C(C=C2)C)OCC3=CC=CS3

InChI

InChI=1S/C22H25NO2S/c1-3-24-22-13-19(15-23-14-18-8-6-17(2)7-9-18)10-11-21(22)25-16-20-5-4-12-26-20/h4-13,23H,3,14-16H2,1-2H3/p+1