2-[4-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]ethanol

Systemtic Name: 2-[4-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]ethanol Openeye Name: 2-[4-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]ethanol CAS Name: 2-[4-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazin-4-iumyl]ethanol IUPAC Name: 2-[4-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]ethanol Traditional Name: 2-[4-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]ethanol Formula: C17H25N4O2+ MolecularWeight: 317.406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=NO2)CCC3=CC=CC=C3)CCO

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=NO2)CCC3=CC=CC=C3)CCO

InChI

InChI=1S/C17H24N4O2/c22-13-12-20-8-10-21(11-9-20)14-17-18-16(19-23-17)7-6-15-4-2-1-3-5-15/h1-5,22H,6-14H2/p+1