(E)-[4-(4-chlorophenyl)-3-hexyl-1,2,3-oxadiazol-3-ium-5-yl]-oxidanidyl-diazene

Systemtic Name: (E)-[4-(4-chlorophenyl)-3-hexyl-1,2,3-oxadiazol-3-ium-5-yl]-oxidanidyl-diazene Openeye Name: (E)-[4-(4-chlorophenyl)-3-hexyl-oxadiazol-3-ium-5-yl]-oxido-diazene CAS Name: (E)-[4-(4-chlorophenyl)-3-hexyl-5-oxadiazol-3-iumyl]-oxidodiazene IUPAC Name: (E)-[4-(4-chlorophenyl)-3-hexyloxadiazol-3-ium-5-yl]-oxidodiazene Traditional Name: (E)-[4-(4-chlorophenyl)-3-hexyl-oxadiazol-3-ium-5-yl]-oxido-diazene Formula: C14H17ClN4O2 MolecularWeight: 308.76338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1=NOC(=C1C2=CC=C(C=C2)Cl)N=N[O-]

Isomeric SMILES

CCCCCC[N+]1=NOC(=C1C2=CC=C(C=C2)Cl)/N=N/[O-]

InChI

InChI=1S/C14H17ClN4O2/c1-2-3-4-5-10-19-13(14(16-17-20)21-18-19)11-6-8-12(15)9-7-11/h6-9H,2-5,10H2,1H3