5-cyclobutyl-3-[4-[dimethyl(sulfonato)azaniumyl]phenyl]-1,2,4-oxadiazole

Systemtic Name: 5-cyclobutyl-3-[4-[dimethyl(sulfonato)azaniumyl]phenyl]-1,2,4-oxadiazole Openeye Name: 5-cyclobutyl-3-[4-[dimethyl(sulfonato)ammonio]phenyl]-1,2,4-oxadiazole CAS Name: 5-cyclobutyl-3-[4-[dimethyl(sulfonato)ammonio]phenyl]-1,2,4-oxadiazole IUPAC Name: 5-cyclobutyl-3-[4-[dimethyl(sulfonato)azaniumyl]phenyl]-1,2,4-oxadiazole Traditional Name: 5-cyclobutyl-3-[4-[dimethyl(sulfonato)ammonio]phenyl]-1,2,4-oxadiazole Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=CC=C(C=C1)C2=NOC(=N2)C3CCC3)S(=O)(=O)[O-]

Isomeric SMILES

C[N+](C)(C1=CC=C(C=C1)C2=NOC(=N2)C3CCC3)S(=O)(=O)[O-]

InChI

InChI=1S/C14H17N3O4S/c1-17(2,22(18,19)20)12-8-6-10(7-9-12)13-15-14(21-16-13)11-4-3-5-11/h6-9,11H,3-5H2,1-2H3