N-[4-(7-bromanyl-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-chloranyl-5-iodanyl-benzamide

Systemtic Name: N-[4-(7-bromanyl-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-chloranyl-5-iodanyl-benzamide Openeye Name: N-[4-(7-bromo-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-chloro-5-iodo-benzamide CAS Name: N-[4-(7-bromo-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-chloro-5-iodobenzamide IUPAC Name: N-[4-(7-bromo-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-chloro-5-iodobenzamide Traditional Name: N-[4-(7-bromo-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-chloro-5-iodo-benzamide Formula: C22H15BrClIN2O2 MolecularWeight: 581.62817

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C(=C1)Br)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)I)Cl

Isomeric SMILES

CCC1=CC2=C(C(=C1)Br)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)I)Cl

InChI

InChI=1S/C22H15BrClIN2O2/c1-2-12-9-17(23)20-19(10-12)27-22(29-20)13-3-6-15(7-4-13)26-21(28)16-11-14(25)5-8-18(16)24/h3-11H,2H2,1H3,(H,26,28)