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

Systemtic Name: [3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(4-fluorophenyl)methyl]azanium Openeye Name: [3-ethoxy-4-(2-thienylmethoxy)phenyl]methyl-[(4-fluorophenyl)methyl]ammonium CAS Name: [3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: [3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(4-fluorophenyl)methyl]azanium Traditional Name: [3-ethoxy-4-(2-thenyloxy)benzyl]-(4-fluorobenzyl)ammonium Formula: C21H23FNO2S+ MolecularWeight: 372.476223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22FNO2S/c1-2-24-21-12-17(14-23-13-16-5-8-18(22)9-6-16)7-10-20(21)25-15-19-4-3-11-26-19/h3-12,23H,2,13-15H2,1H3/p+1