N-[2-(2-chloranyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[2-(2-chloranyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[2-(2-chloro-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[2-(2-chloro-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-2-(2-nitrophenoxy)acetamide Formula: C21H13ClIN3O5 MolecularWeight: 549.70249

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13ClIN3O5/c22-15-7-5-12(23)9-14(15)21-25-16-10-13(6-8-18(16)31-21)24-20(27)11-30-19-4-2-1-3-17(19)26(28)29/h1-10H,11H2,(H,24,27)