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

Systemtic Name: 2-adamantyl-[[4-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]azanium Openeye Name: 2-adamantyl-[[4-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]ammonium CAS Name: 2-adamantyl-[[4-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 2-adamantyl-[[4-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]azanium Traditional Name: 2-adamantyl-[4-(2,4-dichlorobenzyl)oxybenzyl]ammonium Formula: C24H28Cl2NO+ MolecularWeight: 417.39122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27Cl2NO/c25-21-4-3-18(23(26)12-21)14-28-22-5-1-15(2-6-22)13-27-24-19-8-16-7-17(10-19)11-20(24)9-16/h1-6,12,16-17,19-20,24,27H,7-11,13-14H2/p+1