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

Systemtic Name: 2-chloranyl-N-[2-(2-chloranyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[2-(2-chloro-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-5-nitro-benzamide CAS Name: 2-chloro-N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[2-(2-chloro-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-5-nitro-benzamide Formula: C20H10Cl2IN3O4 MolecularWeight: 554.12157

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)N=C(O2)C4=C(C=CC(=C4)I)Cl

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)N=C(O2)C4=C(C=CC(=C4)I)Cl

InChI

InChI=1S/C20H10Cl2IN3O4/c21-15-5-3-12(26(28)29)9-13(15)19(27)24-11-2-6-18-17(8-11)25-20(30-18)14-7-10(23)1-4-16(14)22/h1-9H,(H,24,27)