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1-ethoxycarbonyloxyethyl 3,5-diacetamido-2,4,6-tris(iodanyl)benzoate

1-ethoxycarbonyloxyethyl 3,5-diacetamido-2,4,6-tris(iodanyl)benzoate

Systemtic Name:1-ethoxycarbonyloxyethyl 3,5-diacetamido-2,4,6-tris(iodanyl)benzoate
Openeye Name:1-ethoxycarbonyloxyethyl 3,5-diacetamido-2,4,6-triiodo-benzoate
CAS Name:3,5-diacetamido-2,4,6-triiodobenzoic acid 1-ethoxycarbonyloxyethyl ester
IUPAC Name:1-ethoxycarbonyloxyethyl 3,5-diacetamido-2,4,6-triiodobenzoate
Traditional Name:3,5-diacetamido-2,4,6-triiodo-benzoic acid 1-carbethoxyoxyethyl ester
Formula: C16H17I3N2O7
MolecularWeight: 730.02879
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(C)OC(=O)C1=C(C(=C(C(=C1I)NC(=O)C)I)NC(=O)C)I


Isomeric SMILES

CCOC(=O)OC(C)OC(=O)C1=C(C(=C(C(=C1I)NC(=O)C)I)NC(=O)C)I


InChI

InChI=1S/C16H17I3N2O7/c1-5-26-16(25)28-8(4)27-15(24)9-10(17)13(20-6(2)22)12(19)14(11(9)18)21-7(3)23/h8H,5H2,1-4H3,(H,20,22)(H,21,23)


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