[5-bromanyl-2-[(2-fluorophenyl)methoxy]phenyl]methyl-cycloheptyl-azanium

Systemtic Name: [5-bromanyl-2-[(2-fluorophenyl)methoxy]phenyl]methyl-cycloheptyl-azanium Openeye Name: [5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]methyl-cycloheptyl-ammonium CAS Name: [5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]methyl-cycloheptylammonium IUPAC Name: [5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]methyl-cycloheptylazanium Traditional Name: [5-bromo-2-(2-fluorobenzyl)oxy-benzyl]-cycloheptyl-ammonium Formula: C21H26BrFNO+ MolecularWeight: 407.339643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH2+]CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3F

Isomeric SMILES

C1CCCC(CC1)[NH2+]CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3F

InChI

InChI=1S/C21H25BrFNO/c22-18-11-12-21(25-15-16-7-5-6-10-20(16)23)17(13-18)14-24-19-8-3-1-2-4-9-19/h5-7,10-13,19,24H,1-4,8-9,14-15H2/p+1