2-[2-(2,6-dimethylphenoxy)ethyl]-5-piperazin-4-ium-1-yl-1,3,4-oxadiazole

Systemtic Name: 2-[2-(2,6-dimethylphenoxy)ethyl]-5-piperazin-4-ium-1-yl-1,3,4-oxadiazole Openeye Name: 2-[2-(2,6-dimethylphenoxy)ethyl]-5-piperazin-4-ium-1-yl-1,3,4-oxadiazole CAS Name: 2-[2-(2,6-dimethylphenoxy)ethyl]-5-(1-piperazin-4-iumyl)-1,3,4-oxadiazole IUPAC Name: 2-[2-(2,6-dimethylphenoxy)ethyl]-5-piperazin-4-ium-1-yl-1,3,4-oxadiazole Traditional Name: 2-[2-(2,6-dimethylphenoxy)ethyl]-5-piperazin-4-ium-1-yl-1,3,4-oxadiazole Formula: C16H23N4O2+ MolecularWeight: 303.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCC2=NN=C(O2)N3CC[NH2+]CC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCC2=NN=C(O2)N3CC[NH2+]CC3

InChI

InChI=1S/C16H22N4O2/c1-12-4-3-5-13(2)15(12)21-11-6-14-18-19-16(22-14)20-9-7-17-8-10-20/h3-5,17H,6-11H2,1-2H3/p+1