[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methyl-(2-thienylmethyl)ammonium CAS Name: [4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [4-(4-fluorobenzyl)oxy-3-methoxy-benzyl]-(2-thenyl)ammonium Formula: C20H21FNO2S+ MolecularWeight: 358.449643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CS2)OCC3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CS2)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H20FNO2S/c1-23-20-11-16(12-22-13-18-3-2-10-25-18)6-9-19(20)24-14-15-4-7-17(21)8-5-15/h2-11,22H,12-14H2,1H3/p+1