[(2R,3S)-1-iodanyl-2-methyl-hex-5-yn-3-yl]benzene

Systemtic Name: [(2R,3S)-1-iodanyl-2-methyl-hex-5-yn-3-yl]benzene Openeye Name: [(1S)-1-[(1R)-2-iodo-1-methyl-ethyl]but-3-ynyl]benzene CAS Name: [(2R,3S)-1-iodo-2-methylhex-5-yn-3-yl]benzene IUPAC Name: [(2R,3S)-1-iodo-2-methylhex-5-yn-3-yl]benzene Traditional Name: [(1S)-1-[(1R)-2-iodo-1-methyl-ethyl]but-3-ynyl]benzene Formula: C13H15I MolecularWeight: 298.16267

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Descriptors Computed from Structure

Canonical SMILES:

CC(CI)C(CC#C)C1=CC=CC=C1

Isomeric SMILES

C[C@@H](CI)[C@H](CC#C)C1=CC=CC=C1

InChI

InChI=1S/C13H15I/c1-3-7-13(11(2)10-14)12-8-5-4-6-9-12/h1,4-6,8-9,11,13H,7,10H2,2H3/t11-,13-/m0/s1