[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-chloranyl-2-nitro-benzoate

Systemtic Name: [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-chloranyl-2-nitro-benzoate Openeye Name: [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-chloro-2-nitro-benzoate CAS Name: 5-chloro-2-nitrobenzoic acid [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-chloro-2-nitrobenzoate Traditional Name: 5-chloro-2-nitro-benzoic acid [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C16H9Cl2N3O5 MolecularWeight: 394.16576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(O2)COC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(O2)COC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H9Cl2N3O5/c17-10-3-1-9(2-4-10)15-20-19-14(26-15)8-25-16(22)12-7-11(18)5-6-13(12)21(23)24/h1-7H,8H2