tert-butyl [(Z,4S,5S)-7-iodanyl-5-methyl-oct-6-en-2-yn-4-yl] carbonate

Systemtic Name: tert-butyl [(Z,4S,5S)-7-iodanyl-5-methyl-oct-6-en-2-yn-4-yl] carbonate Openeye Name: tert-butyl [(Z,1S,2S)-4-iodo-2-methyl-1-prop-1-ynyl-pent-3-enyl] carbonate CAS Name: carbonic acid tert-butyl [(Z,4S,5S)-7-iodo-5-methyloct-6-en-2-yn-4-yl] ester IUPAC Name: tert-butyl [(Z,4S,5S)-7-iodo-5-methyloct-6-en-2-yn-4-yl] carbonate Traditional Name: carbonic acid tert-butyl [(Z,1S,2S)-4-iodo-2-methyl-1-prop-1-ynyl-pent-3-enyl] ester Formula: C14H21IO3 MolecularWeight: 364.21921

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C(C)C=C(C)I)OC(=O)OC(C)(C)C

Isomeric SMILES

CC#C[C@H]([C@@H](C)/C=C(/C)\I)OC(=O)OC(C)(C)C

InChI

InChI=1S/C14H21IO3/c1-7-8-12(10(2)9-11(3)15)17-13(16)18-14(4,5)6/h9-10,12H,1-6H3/b11-9-/t10-,12+/m0/s1