5-(5-chloranyl-2-phenylmethoxy-phenyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole

Systemtic Name: 5-(5-chloranyl-2-phenylmethoxy-phenyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole Openeye Name: 5-(2-benzyloxy-5-chloro-phenyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole CAS Name: 5-(5-chloro-2-phenylmethoxyphenyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole IUPAC Name: 5-(5-chloro-2-phenylmethoxyphenyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole Traditional Name: 5-(2-benzoxy-5-chloro-phenyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole Formula: C21H14ClN3O4 MolecularWeight: 407.80656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=NC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=NC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14ClN3O4/c22-16-9-10-19(28-13-14-5-2-1-3-6-14)18(12-16)21-23-20(24-29-21)15-7-4-8-17(11-15)25(26)27/h1-12H,13H2