ethyl 1-[2,3,3-tris(iodanyl)prop-2-enyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2,3,3-tris(iodanyl)prop-2-enyl]pyrrole-3-carboxylate Openeye Name: ethyl 1-(2,3,3-triiodoallyl)pyrrole-3-carboxylate CAS Name: 1-(2,3,3-triiodoprop-2-enyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,3,3-triiodoprop-2-enyl)pyrrole-3-carboxylate Traditional Name: 1-(2,3,3-triiodoallyl)pyrrole-3-carboxylic acid ethyl ester Formula: C10H10I3NO2 MolecularWeight: 556.90531

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C=C1)CC(=C(I)I)I

Isomeric SMILES

CCOC(=O)C1=CN(C=C1)CC(=C(I)I)I

InChI

InChI=1S/C10H10I3NO2/c1-2-16-10(15)7-3-4-14(5-7)6-8(11)9(12)13/h3-5H,2,6H2,1H3