2-azanylethyl 2-azanyl-3-[3,5-bis(iodanyl)-4-(4-oxidanylphenoxy)phenyl]propanoate

Systemtic Name: 2-azanylethyl 2-azanyl-3-[3,5-bis(iodanyl)-4-(4-oxidanylphenoxy)phenyl]propanoate Openeye Name: 2-aminoethyl 2-amino-3-[4-(4-hydroxyphenoxy)-3,5-diiodo-phenyl]propanoate CAS Name: 2-amino-3-[4-(4-hydroxyphenoxy)-3,5-diiodophenyl]propanoic acid 2-aminoethyl ester IUPAC Name: 2-aminoethyl 2-amino-3-[4-(4-hydroxyphenoxy)-3,5-diiodophenyl]propanoate Traditional Name: 2-amino-3-[4-(4-hydroxyphenoxy)-3,5-diiodo-phenyl]propionic acid 2-aminoethyl ester Formula: C17H18I2N2O4 MolecularWeight: 568.14476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1O)OC2=C(C=C(C=C2I)CC(C(=O)OCCN)N)I

Isomeric SMILES

C1=CC(=CC=C1O)OC2=C(C=C(C=C2I)CC(C(=O)OCCN)N)I

InChI

InChI=1S/C17H18I2N2O4/c18-13-7-10(9-15(21)17(23)24-6-5-20)8-14(19)16(13)25-12-3-1-11(22)2-4-12/h1-4,7-8,15,22H,5-6,9,20-21H2