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

Systemtic Name: [5-bromanyl-2-[(4-methylphenyl)methoxy]phenyl]methyl-cyclohexyl-azanium Openeye Name: [5-bromo-2-(p-tolylmethoxy)phenyl]methyl-cyclohexyl-ammonium CAS Name: [5-bromo-2-[(4-methylphenyl)methoxy]phenyl]methyl-cyclohexylammonium IUPAC Name: [5-bromo-2-[(4-methylphenyl)methoxy]phenyl]methyl-cyclohexylazanium Traditional Name: [5-bromo-2-(4-methylbenzyl)oxy-benzyl]-cyclohexyl-ammonium Formula: C21H27BrNO+ MolecularWeight: 389.34918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C[NH2+]C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C[NH2+]C3CCCCC3

InChI

InChI=1S/C21H26BrNO/c1-16-7-9-17(10-8-16)15-24-21-12-11-19(22)13-18(21)14-23-20-5-3-2-4-6-20/h7-13,20,23H,2-6,14-15H2,1H3/p+1