butyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]-(phenylmethyl)azanium

Systemtic Name: butyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-butyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]ammonium CAS Name: butyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-butyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]azanium Traditional Name: benzyl-butyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]ammonium Formula: C22H28N3O+ MolecularWeight: 350.47722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=CC=CC=C1)CC2=NC(=NO2)CCC3=CC=CC=C3

Isomeric SMILES

CCCC[NH+](CC1=CC=CC=C1)CC2=NC(=NO2)CCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O/c1-2-3-16-25(17-20-12-8-5-9-13-20)18-22-23-21(24-26-22)15-14-19-10-6-4-7-11-19/h4-13H,2-3,14-18H2,1H3/p+1