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2-azanyl-3-[4-(2-bromoethyloxy)-3,5-bis(iodanyl)phenyl]propanoic acid

2-azanyl-3-[4-(2-bromoethyloxy)-3,5-bis(iodanyl)phenyl]propanoic acid

Systemtic Name:2-azanyl-3-[4-(2-bromoethyloxy)-3,5-bis(iodanyl)phenyl]propanoic acid
Openeye Name:2-amino-3-[4-(2-bromoethoxy)-3,5-diiodo-phenyl]propanoic acid
CAS Name:2-amino-3-[4-(2-bromoethoxy)-3,5-diiodophenyl]propanoic acid
IUPAC Name:2-amino-3-[4-(2-bromoethoxy)-3,5-diiodophenyl]propanoic acid
Traditional Name:2-amino-3-[4-(2-bromoethoxy)-3,5-diiodo-phenyl]propionic acid
Formula: C11H12BrI2NO3
MolecularWeight: 539.93082
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1I)OCCBr)I)CC(C(=O)O)N


Isomeric SMILES

C1=C(C=C(C(=C1I)OCCBr)I)CC(C(=O)O)N


InChI

InChI=1S/C11H12BrI2NO3/c12-1-2-18-10-7(13)3-6(4-8(10)14)5-9(15)11(16)17/h3-4,9H,1-2,5,15H2,(H,16,17)


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