3-bromanyl-N-[2-(2-chloranyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-4-methoxy-benzamide

Systemtic Name: 3-bromanyl-N-[2-(2-chloranyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[2-(2-chloro-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[2-(2-chloro-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-4-methoxy-benzamide Formula: C21H13BrClIN2O3 MolecularWeight: 583.60099

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)I)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)I)Cl)Br

InChI

InChI=1S/C21H13BrClIN2O3/c1-28-18-6-2-11(8-15(18)22)20(27)25-13-4-7-19-17(10-13)26-21(29-19)14-9-12(24)3-5-16(14)23/h2-10H,1H3,(H,25,27)