1-adamantyl-[[5-chloranyl-2-[(4-chlorophenyl)methoxy]phenyl]methyl]azanium

Systemtic Name: 1-adamantyl-[[5-chloranyl-2-[(4-chlorophenyl)methoxy]phenyl]methyl]azanium Openeye Name: 1-adamantyl-[[5-chloro-2-[(4-chlorophenyl)methoxy]phenyl]methyl]ammonium CAS Name: 1-adamantyl-[[5-chloro-2-[(4-chlorophenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[5-chloro-2-[(4-chlorophenyl)methoxy]phenyl]methyl]azanium Traditional Name: 1-adamantyl-[5-chloro-2-(4-chlorobenzyl)oxy-benzyl]ammonium Formula: C24H28Cl2NO+ MolecularWeight: 417.39122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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