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

Systemtic Name: N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-4-iodanyl-benzamide Openeye Name: N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-4-iodo-benzamide CAS Name: N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-4-iodobenzamide IUPAC Name: N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-4-iodobenzamide Traditional Name: N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-4-iodo-benzamide Formula: C22H17IN2O2 MolecularWeight: 468.28705

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17IN2O2/c1-13-3-9-18(14(2)11-13)22-25-19-12-17(8-10-20(19)27-22)24-21(26)15-4-6-16(23)7-5-15/h3-12H,1-2H3,(H,24,26)