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

Systemtic Name: [3-bromanyl-4-[(4-chlorophenyl)methoxy]phenyl]methyl-cycloheptyl-azanium Openeye Name: [3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]methyl-cycloheptyl-ammonium CAS Name: [3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]methyl-cycloheptylammonium IUPAC Name: [3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]methyl-cycloheptylazanium Traditional Name: [3-bromo-4-(4-chlorobenzyl)oxy-benzyl]-cycloheptyl-ammonium Formula: C21H26BrClNO+ MolecularWeight: 423.79424

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH2+]CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)Br

Isomeric SMILES

C1CCCC(CC1)[NH2+]CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C21H25BrClNO/c22-20-13-17(14-24-19-5-3-1-2-4-6-19)9-12-21(20)25-15-16-7-10-18(23)11-8-16/h7-13,19,24H,1-6,14-15H2/p+1