[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-chloranyl-1-benzofuran-2-carboxylate

Systemtic Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-chloranyl-1-benzofuran-2-carboxylate Openeye Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-chlorobenzofuran-2-carboxylate CAS Name: 5-chloro-2-benzofurancarboxylic acid [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-chloro-1-benzofuran-2-carboxylate Traditional Name: 5-chlorocoumarilic acid [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C18H10ClN3O6 MolecularWeight: 399.7415

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(O2)COC(=O)C3=CC4=C(O3)C=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(O2)COC(=O)C3=CC4=C(O3)C=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H10ClN3O6/c19-12-3-6-14-11(7-12)8-15(27-14)18(23)26-9-16-20-21-17(28-16)10-1-4-13(5-2-10)22(24)25/h1-8H,9H2