4-[3-ethyl-2,4,6-tris(iodanyl)phenyl]-2-nitro-benzoic acid

Systemtic Name: 4-[3-ethyl-2,4,6-tris(iodanyl)phenyl]-2-nitro-benzoic acid Openeye Name: 4-(3-ethyl-2,4,6-triiodo-phenyl)-2-nitro-benzoic acid CAS Name: 4-(3-ethyl-2,4,6-triiodophenyl)-2-nitrobenzoic acid IUPAC Name: 4-(3-ethyl-2,4,6-triiodophenyl)-2-nitrobenzoic acid Traditional Name: 4-(3-ethyl-2,4,6-triiodo-phenyl)-2-nitro-benzoic acid Formula: C15H10I3NO4 MolecularWeight: 648.95761

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1I)C2=CC(=C(C=C2)C(=O)O)[N+](=O)[O-])I)I

Isomeric SMILES

CCC1=C(C=C(C(=C1I)C2=CC(=C(C=C2)C(=O)O)[N+](=O)[O-])I)I

InChI

InChI=1S/C15H10I3NO4/c1-2-8-10(16)6-11(17)13(14(8)18)7-3-4-9(15(20)21)12(5-7)19(22)23/h3-6H,2H2,1H3,(H,20,21)