2-(azocan-1-ium-1-ylmethyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(azocan-1-ium-1-ylmethyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole Openeye Name: 2-(azocan-1-ium-1-ylmethyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole CAS Name: 2-(1-azocan-1-iumylmethyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole IUPAC Name: 2-(azocan-1-ium-1-ylmethyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole Traditional Name: 2-(azocan-1-ium-1-ylmethyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole Formula: C16H21ClN3O+ MolecularWeight: 306.81044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)CC2=NN=C(O2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC[NH+](CCC1)CC2=NN=C(O2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H20ClN3O/c17-14-8-6-13(7-9-14)16-19-18-15(21-16)12-20-10-4-2-1-3-5-11-20/h6-9H,1-5,10-12H2/p+1