(3-chloranyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl-[(4-fluorophenyl)methyl]azanium

Systemtic Name: (3-chloranyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl-[(4-fluorophenyl)methyl]azanium Openeye Name: (4-benzyloxy-3-chloro-5-ethoxy-phenyl)methyl-[(4-fluorophenyl)methyl]ammonium CAS Name: (3-chloro-5-ethoxy-4-phenylmethoxyphenyl)methyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: (3-chloro-5-ethoxy-4-phenylmethoxyphenyl)methyl-[(4-fluorophenyl)methyl]azanium Traditional Name: (4-benzoxy-3-chloro-5-ethoxy-benzyl)-(4-fluorobenzyl)ammonium Formula: C23H24ClFNO2+ MolecularWeight: 400.893563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CC2=CC=C(C=C2)F)Cl)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CC2=CC=C(C=C2)F)Cl)OCC3=CC=CC=C3

InChI

InChI=1S/C23H23ClFNO2/c1-2-27-22-13-19(15-26-14-17-8-10-20(25)11-9-17)12-21(24)23(22)28-16-18-6-4-3-5-7-18/h3-13,26H,2,14-16H2,1H3/p+1