disodium 2-azanyl-3-[3,5-bis(iodanyl)-4-(3-iodanyl-4-oxidanidyl-phenoxy)phenyl]-2-methyl-propanoate

Systemtic Name: disodium 2-azanyl-3-[3,5-bis(iodanyl)-4-(3-iodanyl-4-oxidanidyl-phenoxy)phenyl]-2-methyl-propanoate Openeye Name: disodium 2-amino-3-[3,5-diiodo-4-(3-iodo-4-oxido-phenoxy)phenyl]-2-methyl-propanoate CAS Name: disodium 2-amino-3-[3,5-diiodo-4-(3-iodo-4-oxidophenoxy)phenyl]-2-methylpropanoate IUPAC Name: disodium 2-amino-3-[3,5-diiodo-4-(3-iodo-4-oxidophenoxy)phenyl]-2-methylpropanoate Traditional Name: disodium 2-amino-3-[3,5-diiodo-4-(3-iodo-4-oxido-phenoxy)phenyl]-2-methyl-propionate Formula: C16H12I3NNa2O4 MolecularWeight: 708.96373

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C(=C1)I)OC2=CC(=C(C=C2)[O-])I)I)(C(=O)[O-])N.[Na+].[Na+]

Isomeric SMILES

CC(CC1=CC(=C(C(=C1)I)OC2=CC(=C(C=C2)[O-])I)I)(C(=O)[O-])N.[Na+].[Na+]

InChI

InChI=1S/C16H14I3NO4.2Na/c1-16(20,15(22)23)7-8-4-11(18)14(12(19)5-8)24-9-2-3-13(21)10(17)6-9;;/h2-6,21H,7,20H2,1H3,(H,22,23);;/q;2*+1/p-2