[3-bromanyl-4-[(4-chlorophenyl)methoxy]phenyl]methyl-cyclooctyl-azanium

Systemtic Name: [3-bromanyl-4-[(4-chlorophenyl)methoxy]phenyl]methyl-cyclooctyl-azanium Openeye Name: [3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]methyl-cyclooctyl-ammonium CAS Name: [3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]methyl-cyclooctylammonium IUPAC Name: [3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]methyl-cyclooctylazanium Traditional Name: [3-bromo-4-(4-chlorobenzyl)oxy-benzyl]-cyclooctyl-ammonium Formula: C22H28BrClNO+ MolecularWeight: 437.82082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)[NH2+]CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)Br

Isomeric SMILES

C1CCCC(CCC1)[NH2+]CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C22H27BrClNO/c23-21-14-18(15-25-20-6-4-2-1-3-5-7-20)10-13-22(21)26-16-17-8-11-19(24)12-9-17/h8-14,20,25H,1-7,15-16H2/p+1