[5-bromanyl-2-[(4-methylphenyl)methoxy]phenyl]methyl-cyclooctyl-azanium

Systemtic Name: [5-bromanyl-2-[(4-methylphenyl)methoxy]phenyl]methyl-cyclooctyl-azanium Openeye Name: [5-bromo-2-(p-tolylmethoxy)phenyl]methyl-cyclooctyl-ammonium CAS Name: [5-bromo-2-[(4-methylphenyl)methoxy]phenyl]methyl-cyclooctylammonium IUPAC Name: [5-bromo-2-[(4-methylphenyl)methoxy]phenyl]methyl-cyclooctylazanium Traditional Name: [5-bromo-2-(4-methylbenzyl)oxy-benzyl]-cyclooctyl-ammonium Formula: C23H31BrNO+ MolecularWeight: 417.40234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C[NH2+]C3CCCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C[NH2+]C3CCCCCCC3

InChI

InChI=1S/C23H30BrNO/c1-18-9-11-19(12-10-18)17-26-23-14-13-21(24)15-20(23)16-25-22-7-5-3-2-4-6-8-22/h9-15,22,25H,2-8,16-17H2,1H3/p+1