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

Systemtic Name: (3-chloranyl-5-methoxy-4-phenylmethoxy-phenyl)methyl-[(4-fluorophenyl)methyl]azanium Openeye Name: (4-benzyloxy-3-chloro-5-methoxy-phenyl)methyl-[(4-fluorophenyl)methyl]ammonium CAS Name: (3-chloro-5-methoxy-4-phenylmethoxyphenyl)methyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: (3-chloro-5-methoxy-4-phenylmethoxyphenyl)methyl-[(4-fluorophenyl)methyl]azanium Traditional Name: (4-benzoxy-3-chloro-5-methoxy-benzyl)-(4-fluorobenzyl)ammonium Formula: C22H22ClFNO2+ MolecularWeight: 386.866983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CC2=CC=C(C=C2)F)Cl)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CC2=CC=C(C=C2)F)Cl)OCC3=CC=CC=C3

InChI

InChI=1S/C22H21ClFNO2/c1-26-21-12-18(14-25-13-16-7-9-19(24)10-8-16)11-20(23)22(21)27-15-17-5-3-2-4-6-17/h2-12,25H,13-15H2,1H3/p+1