[3-(cyclohexyl-oxidanyl-phenyl-methyl)-1,2,4-oxadiazol-5-yl]methyl-dimethyl-(4-phenylbutyl)azanium

Systemtic Name: [3-(cyclohexyl-oxidanyl-phenyl-methyl)-1,2,4-oxadiazol-5-yl]methyl-dimethyl-(4-phenylbutyl)azanium Openeye Name: [3-(cyclohexyl-hydroxy-phenyl-methyl)-1,2,4-oxadiazol-5-yl]methyl-dimethyl-(4-phenylbutyl)ammonium CAS Name: [3-(cyclohexyl-hydroxy-phenylmethyl)-1,2,4-oxadiazol-5-yl]methyl-dimethyl-(4-phenylbutyl)ammonium IUPAC Name: [3-(cyclohexyl-hydroxy-phenylmethyl)-1,2,4-oxadiazol-5-yl]methyl-dimethyl-(4-phenylbutyl)azanium Traditional Name: [3-(cyclohexyl-hydroxy-phenyl-methyl)-1,2,4-oxadiazol-5-yl]methyl-dimethyl-(4-phenylbutyl)ammonium Formula: C28H38N3O2+ MolecularWeight: 448.62022

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCCC1=CC=CC=C1)CC2=NC(=NO2)C(C3CCCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

C[N+](C)(CCCCC1=CC=CC=C1)CC2=NC(=NO2)C(C3CCCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C28H38N3O2/c1-31(2,21-13-12-16-23-14-6-3-7-15-23)22-26-29-27(30-33-26)28(32,24-17-8-4-9-18-24)25-19-10-5-11-20-25/h3-4,6-9,14-15,17-18,25,32H,5,10-13,16,19-22H2,1-2H3/q+1