1-adamantyl-[[2-[(2,4-dichlorophenyl)methoxy]naphthalen-1-yl]methyl]azanium

Systemtic Name: 1-adamantyl-[[2-[(2,4-dichlorophenyl)methoxy]naphthalen-1-yl]methyl]azanium Openeye Name: 1-adamantyl-[[2-[(2,4-dichlorophenyl)methoxy]-1-naphthyl]methyl]ammonium CAS Name: 1-adamantyl-[[2-[(2,4-dichlorophenyl)methoxy]-1-naphthalenyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[2-[(2,4-dichlorophenyl)methoxy]naphthalen-1-yl]methyl]azanium Traditional Name: 1-adamantyl-[[2-(2,4-dichlorobenzyl)oxy-1-naphthyl]methyl]ammonium Formula: C28H30Cl2NO+ MolecularWeight: 467.4499

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=C(C=CC5=CC=CC=C54)OCC6=C(C=C(C=C6)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=C(C=CC5=CC=CC=C54)OCC6=C(C=C(C=C6)Cl)Cl

InChI

InChI=1S/C28H29Cl2NO/c29-23-7-5-22(26(30)12-23)17-32-27-8-6-21-3-1-2-4-24(21)25(27)16-31-28-13-18-9-19(14-28)11-20(10-18)15-28/h1-8,12,18-20,31H,9-11,13-17H2/p+1