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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NOC(=N2)COC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=NOC(=N2)COC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])Cl

InChI

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