ethyl (2S,3R)-2-hex-3-ynyl-1-iodanyl-3-methyl-cyclopentane-1-carboxylate

Systemtic Name: ethyl (2S,3R)-2-hex-3-ynyl-1-iodanyl-3-methyl-cyclopentane-1-carboxylate Openeye Name: ethyl (2S,3R)-2-hex-3-ynyl-1-iodo-3-methyl-cyclopentanecarboxylate CAS Name: (2S,3R)-2-hex-3-ynyl-1-iodo-3-methyl-1-cyclopentanecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2-hex-3-ynyl-1-iodo-3-methylcyclopentane-1-carboxylate Traditional Name: (2S,3R)-2-hex-3-ynyl-1-iodo-3-methyl-cyclopentanecarboxylic acid ethyl ester Formula: C15H23IO2 MolecularWeight: 362.24639

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCCC1C(CCC1(C(=O)OCC)I)C

Isomeric SMILES

CCC#CCC[C@H]1[C@@H](CCC1(C(=O)OCC)I)C

InChI

InChI=1S/C15H23IO2/c1-4-6-7-8-9-13-12(3)10-11-15(13,16)14(17)18-5-2/h12-13H,4-5,8-11H2,1-3H3/t12-,13+,15?/m1/s1