1-adamantyl-[[5-bromanyl-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]azanium

Systemtic Name: 1-adamantyl-[[5-bromanyl-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]azanium Openeye Name: 1-adamantyl-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]ammonium CAS Name: 1-adamantyl-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]azanium Traditional Name: 1-adamantyl-[5-bromo-2-(2,4-dichlorobenzyl)oxy-benzyl]ammonium Formula: C24H27BrCl2NO+ MolecularWeight: 496.28728

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=C(C=CC(=C4)Br)OCC5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=C(C=CC(=C4)Br)OCC5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C24H26BrCl2NO/c25-20-2-4-23(29-14-18-1-3-21(26)9-22(18)27)19(8-20)13-28-24-10-15-5-16(11-24)7-17(6-15)12-24/h1-4,8-9,15-17,28H,5-7,10-14H2/p+1