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

Systemtic Name: [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-chloranyl-3-nitro-benzoate Openeye Name: [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H12ClN3O6 MolecularWeight: 389.74668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=N2)COC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=N2)COC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H12ClN3O6/c1-25-14-5-3-2-4-11(14)16-19-15(27-20-16)9-26-17(22)10-6-7-12(18)13(8-10)21(23)24/h2-8H,9H2,1H3