2-[3-(carboxymethyl)-2-iodyl-4,5-dinitro-phenyl]ethanoic acid

Systemtic Name: 2-[3-(carboxymethyl)-2-iodyl-4,5-dinitro-phenyl]ethanoic acid Openeye Name: 2-[3-(carboxymethyl)-2-iodyl-4,5-dinitro-phenyl]acetic acid CAS Name: 2-[3-(carboxymethyl)-2-iodyl-4,5-dinitrophenyl]acetic acid IUPAC Name: 2-[3-(carboxymethyl)-2-iodyl-4,5-dinitrophenyl]acetic acid Traditional Name: 2-[3-(carboxymethyl)-2-iodyl-4,5-dinitro-phenyl]acetic acid Formula: C10H7IN2O10 MolecularWeight: 442.07445

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])CC(=O)O)I(=O)=O)CC(=O)O

Isomeric SMILES

C1=C(C(=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])CC(=O)O)I(=O)=O)CC(=O)O

InChI

InChI=1S/C10H7IN2O10/c14-7(15)2-4-1-6(12(20)21)10(13(22)23)5(3-8(16)17)9(4)11(18)19/h1H,2-3H2,(H,14,15)(H,16,17)