N-[2-(2-chloranyl-4-fluoranyl-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide

Systemtic Name: N-[2-(2-chloranyl-4-fluoranyl-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide Openeye Name: N-[2-(2-chloro-4-fluoro-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide CAS Name: N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide IUPAC Name: N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide Traditional Name: N-[2-(2-chloro-4-fluoro-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide Formula: C20H11ClFN3O4 MolecularWeight: 411.770443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C20H11ClFN3O4/c21-16-9-12(22)4-6-15(16)20-24-17-10-13(5-7-18(17)29-20)23-19(26)11-2-1-3-14(8-11)25(27)28/h1-10H,(H,23,26)