[3-bromanyl-4-[(3,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl-cyclohexyl-azanium

Systemtic Name: [3-bromanyl-4-[(3,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl-cyclohexyl-azanium Openeye Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl-cyclohexyl-ammonium CAS Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methyl-cyclohexylammonium IUPAC Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methyl-cyclohexylazanium Traditional Name: [3-bromo-4-(3,4-dichlorobenzyl)oxy-5-methoxy-benzyl]-cyclohexyl-ammonium Formula: C21H25BrCl2NO2+ MolecularWeight: 474.2387

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]C2CCCCC2)Br)OCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]C2CCCCC2)Br)OCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H24BrCl2NO2/c1-26-20-11-15(12-25-16-5-3-2-4-6-16)9-17(22)21(20)27-13-14-7-8-18(23)19(24)10-14/h7-11,16,25H,2-6,12-13H2,1H3/p+1