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ethyl (2S)-2-benzamido-3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]propanoate

ethyl (2S)-2-benzamido-3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]propanoate

Systemtic Name:ethyl (2S)-2-benzamido-3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]propanoate
Openeye Name:ethyl (2S)-2-benzamido-3-(4-hydroxy-3,5-diiodo-phenyl)propanoate
CAS Name:(2S)-2-benzamido-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid ethyl ester
IUPAC Name:ethyl (2S)-2-benzamido-3-(4-hydroxy-3,5-diiodophenyl)propanoate
Traditional Name:(2S)-2-benzamido-3-(4-hydroxy-3,5-diiodo-phenyl)propionic acid ethyl ester
Formula: C18H17I2NO4
MolecularWeight: 565.14082
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C(=C1)I)O)I)NC(=O)C2=CC=CC=C2


Isomeric SMILES

CCOC(=O)[C@H](CC1=CC(=C(C(=C1)I)O)I)NC(=O)C2=CC=CC=C2


InChI

InChI=1S/C18H17I2NO4/c1-2-25-18(24)15(21-17(23)12-6-4-3-5-7-12)10-11-8-13(19)16(22)14(20)9-11/h3-9,15,22H,2,10H2,1H3,(H,21,23)/t15-/m0/s1


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