N-[3-acetamido-2,4,6-tris(iodanyl)-5-(4-methyl-3-nitro-phenyl)phenyl]ethanamide

Systemtic Name: N-[3-acetamido-2,4,6-tris(iodanyl)-5-(4-methyl-3-nitro-phenyl)phenyl]ethanamide Openeye Name: N-[3-acetamido-2,4,6-triiodo-5-(4-methyl-3-nitro-phenyl)phenyl]acetamide CAS Name: N-[3-acetamido-2,4,6-triiodo-5-(4-methyl-3-nitrophenyl)phenyl]acetamide IUPAC Name: N-[3-acetamido-2,4,6-triiodo-5-(4-methyl-3-nitrophenyl)phenyl]acetamide Traditional Name: N-[3-acetamido-2,4,6-triiodo-5-(4-methyl-3-nitro-phenyl)phenyl]acetamide Formula: C17H14I3N3O4 MolecularWeight: 705.02417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=C(C(=C2I)NC(=O)C)I)NC(=O)C)I)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=C(C(=C2I)NC(=O)C)I)NC(=O)C)I)[N+](=O)[O-]

InChI

InChI=1S/C17H14I3N3O4/c1-7-4-5-10(6-11(7)23(26)27)12-13(18)16(21-8(2)24)15(20)17(14(12)19)22-9(3)25/h4-6H,1-3H3,(H,21,24)(H,22,25)