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

Systemtic Name: [4-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [4-[(2-chloro-4-fluoro-phenyl)methoxy]-3-methoxy-phenyl]methyl-(2-thienylmethyl)ammonium CAS Name: [4-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [4-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [4-(2-chloro-4-fluoro-benzyl)oxy-3-methoxy-benzyl]-(2-thenyl)ammonium Formula: C20H20ClFNO2S+ MolecularWeight: 392.894703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClFNO2S/c1-24-20-9-14(11-23-12-17-3-2-8-26-17)4-7-19(20)25-13-15-5-6-16(22)10-18(15)21/h2-10,23H,11-13H2,1H3/p+1