3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]-2-[2-(3-oxidanylpropanoylamino)benzimidazol-1-yl]propanamide

Systemtic Name: 3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]-2-[2-(3-oxidanylpropanoylamino)benzimidazol-1-yl]propanamide Openeye Name: 3-(4-hydroxy-3,5-diiodo-phenyl)-2-[2-(3-hydroxypropanoylamino)benzimidazol-1-yl]propanamide CAS Name: 3-(4-hydroxy-3,5-diiodophenyl)-2-[2-[(3-hydroxy-1-oxopropyl)amino]-1-benzimidazolyl]propanamide IUPAC Name: 3-(4-hydroxy-3,5-diiodophenyl)-2-[2-(3-hydroxypropanoylamino)benzimidazol-1-yl]propanamide Traditional Name: 3-(4-hydroxy-3,5-diiodo-phenyl)-2-[2-(3-hydroxypropanoylamino)benzimidazol-1-yl]propionamide Formula: C19H18I2N4O4 MolecularWeight: 620.17956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2C(CC3=CC(=C(C(=C3)I)O)I)C(=O)N)NC(=O)CCO

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2C(CC3=CC(=C(C(=C3)I)O)I)C(=O)N)NC(=O)CCO

InChI

InChI=1S/C19H18I2N4O4/c20-11-7-10(8-12(21)17(11)28)9-15(18(22)29)25-14-4-2-1-3-13(14)23-19(25)24-16(27)5-6-26/h1-4,7-8,15,26,28H,5-6,9H2,(H2,22,29)(H,23,24,27)