2-(1-adamantyl)ethyl-methyl-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]azanium

Systemtic Name: 2-(1-adamantyl)ethyl-methyl-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]azanium Openeye Name: 2-(1-adamantyl)ethyl-methyl-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium CAS Name: 2-(1-adamantyl)ethyl-methyl-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium IUPAC Name: 2-(1-adamantyl)ethyl-methyl-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]azanium Traditional Name: 2-(1-adamantyl)ethyl-methyl-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium Formula: C23H32N3O2+ MolecularWeight: 382.51908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC12CC3CC(C1)CC(C3)C2)CC4=NC(=NO4)COC5=CC=CC=C5

Isomeric SMILES

C[NH+](CCC12CC3CC(C1)CC(C3)C2)CC4=NC(=NO4)COC5=CC=CC=C5

InChI

InChI=1S/C23H31N3O2/c1-26(8-7-23-12-17-9-18(13-23)11-19(10-17)14-23)15-22-24-21(25-28-22)16-27-20-5-3-2-4-6-20/h2-6,17-19H,7-16H2,1H3/p+1