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

Systemtic Name: 5-(azepan-1-ium-1-ylmethyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole Openeye Name: 5-(azepan-1-ium-1-ylmethyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole CAS Name: 5-(1-azepan-1-iumylmethyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole IUPAC Name: 5-(azepan-1-ium-1-ylmethyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole Traditional Name: 5-(azepan-1-ium-1-ylmethyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole Formula: C15H19ClN3O+ MolecularWeight: 292.78386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC2=NC(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC[NH+](CC1)CC2=NC(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H18ClN3O/c16-13-7-5-12(6-8-13)15-17-14(20-18-15)11-19-9-3-1-2-4-10-19/h5-8H,1-4,9-11H2/p+1