N-[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-2,5-bis(iodanyl)benzamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-2,5-bis(iodanyl)benzamide Openeye Name: N-[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-2,5-diiodo-benzamide CAS Name: N-[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide IUPAC Name: N-[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide Traditional Name: N-[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-2,5-diiodo-benzamide Formula: C22H16I2N2O2 MolecularWeight: 594.18358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C=CC(=C4)I)I)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C=CC(=C4)I)I)C

InChI

InChI=1S/C22H16I2N2O2/c1-12-3-4-14(9-13(12)2)22-26-19-11-16(6-8-20(19)28-22)25-21(27)17-10-15(23)5-7-18(17)24/h3-11H,1-2H3,(H,25,27)