2-(3-chloranylpropyl)-5-(4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(3-chloranylpropyl)-5-(4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazole Openeye Name: 2-(3-chloropropyl)-5-(4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazole CAS Name: 2-(3-chloropropyl)-5-(4-methoxy-3-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-(3-chloropropyl)-5-(4-methoxy-3-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-(3-chloropropyl)-5-(4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazole Formula: C12H12ClN3O4 MolecularWeight: 297.69438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(O2)CCCCl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(O2)CCCCl)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClN3O4/c1-19-10-5-4-8(7-9(10)16(17)18)12-15-14-11(20-12)3-2-6-13/h4-5,7H,2-3,6H2,1H3