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

Systemtic Name: 1-adamantyl-[[4-[(4-chlorophenyl)methoxy]phenyl]methyl]azanium Openeye Name: 1-adamantyl-[[4-[(4-chlorophenyl)methoxy]phenyl]methyl]ammonium CAS Name: 1-adamantyl-[[4-[(4-chlorophenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[4-[(4-chlorophenyl)methoxy]phenyl]methyl]azanium Traditional Name: 1-adamantyl-[4-(4-chlorobenzyl)oxybenzyl]ammonium Formula: C24H29ClNO+ MolecularWeight: 382.94616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28ClNO/c25-22-5-1-18(2-6-22)16-27-23-7-3-17(4-8-23)15-26-24-12-19-9-20(13-24)11-21(10-19)14-24/h1-8,19-21,26H,9-16H2/p+1