2,3,5-tris(iodanyl)-N-[3-(3-methylphenoxy)-5-nitro-phenyl]benzamide

Systemtic Name: 2,3,5-tris(iodanyl)-N-[3-(3-methylphenoxy)-5-nitro-phenyl]benzamide Openeye Name: 2,3,5-triiodo-N-[3-(3-methylphenoxy)-5-nitro-phenyl]benzamide CAS Name: 2,3,5-triiodo-N-[3-(3-methylphenoxy)-5-nitrophenyl]benzamide IUPAC Name: 2,3,5-triiodo-N-[3-(3-methylphenoxy)-5-nitrophenyl]benzamide Traditional Name: 2,3,5-triiodo-N-[3-(3-methylphenoxy)-5-nitro-phenyl]benzamide Formula: C20H13I3N2O4 MolecularWeight: 726.04163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=CC(=C3I)I)I

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=CC(=C3I)I)I

InChI

InChI=1S/C20H13I3N2O4/c1-11-3-2-4-15(5-11)29-16-9-13(8-14(10-16)25(27)28)24-20(26)17-6-12(21)7-18(22)19(17)23/h2-10H,1H3,(H,24,26)