2-[(2,5-dimethylphenoxy)methyl]-5-piperazin-4-ium-1-yl-1,3,4-oxadiazole

Systemtic Name: 2-[(2,5-dimethylphenoxy)methyl]-5-piperazin-4-ium-1-yl-1,3,4-oxadiazole Openeye Name: 2-[(2,5-dimethylphenoxy)methyl]-5-piperazin-4-ium-1-yl-1,3,4-oxadiazole CAS Name: 2-[(2,5-dimethylphenoxy)methyl]-5-(1-piperazin-4-iumyl)-1,3,4-oxadiazole IUPAC Name: 2-[(2,5-dimethylphenoxy)methyl]-5-piperazin-4-ium-1-yl-1,3,4-oxadiazole Traditional Name: 2-[(2,5-dimethylphenoxy)methyl]-5-piperazin-4-ium-1-yl-1,3,4-oxadiazole Formula: C15H21N4O2+ MolecularWeight: 289.35284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC2=NN=C(O2)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC2=NN=C(O2)N3CC[NH2+]CC3

InChI

InChI=1S/C15H20N4O2/c1-11-3-4-12(2)13(9-11)20-10-14-17-18-15(21-14)19-7-5-16-6-8-19/h3-4,9,16H,5-8,10H2,1-2H3/p+1