[3,5-bis(bromanyl)-4-ethoxy-phenyl]methyl-[(4-fluorophenyl)methyl]azanium

Systemtic Name: [3,5-bis(bromanyl)-4-ethoxy-phenyl]methyl-[(4-fluorophenyl)methyl]azanium Openeye Name: (3,5-dibromo-4-ethoxy-phenyl)methyl-[(4-fluorophenyl)methyl]ammonium CAS Name: (3,5-dibromo-4-ethoxyphenyl)methyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: (3,5-dibromo-4-ethoxyphenyl)methyl-[(4-fluorophenyl)methyl]azanium Traditional Name: (3,5-dibromo-4-ethoxy-benzyl)-(4-fluorobenzyl)ammonium Formula: C16H17Br2FNO+ MolecularWeight: 418.118683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C[NH2+]CC2=CC=C(C=C2)F)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C[NH2+]CC2=CC=C(C=C2)F)Br

InChI

InChI=1S/C16H16Br2FNO/c1-2-21-16-14(17)7-12(8-15(16)18)10-20-9-11-3-5-13(19)6-4-11/h3-8,20H,2,9-10H2,1H3/p+1