[4-(2-bromanyl-4-methyl-phenoxy)-3-fluoranyl-phenyl]methylazanium

Systemtic Name: [4-(2-bromanyl-4-methyl-phenoxy)-3-fluoranyl-phenyl]methylazanium Openeye Name: [4-(2-bromo-4-methyl-phenoxy)-3-fluoro-phenyl]methylammonium CAS Name: [4-(2-bromo-4-methylphenoxy)-3-fluorophenyl]methylammonium IUPAC Name: [4-(2-bromo-4-methylphenoxy)-3-fluorophenyl]methylazanium Traditional Name: [4-(2-bromo-4-methyl-phenoxy)-3-fluoro-benzyl]ammonium Formula: C14H14BrFNO+ MolecularWeight: 311.169463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=C(C=C(C=C2)C[NH3+])F)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=C(C=C(C=C2)C[NH3+])F)Br

InChI

InChI=1S/C14H13BrFNO/c1-9-2-4-13(11(15)6-9)18-14-5-3-10(8-17)7-12(14)16/h2-7H,8,17H2,1H3/p+1