[(2S,3S)-1-iodanyl-2,4-dimethyl-pentan-3-yl] propanoate

Systemtic Name: [(2S,3S)-1-iodanyl-2,4-dimethyl-pentan-3-yl] propanoate Openeye Name: [(1S,2S)-3-iodo-1-isopropyl-2-methyl-propyl] propanoate CAS Name: propanoic acid [(2S,3S)-1-iodo-2,4-dimethylpentan-3-yl] ester IUPAC Name: [(2S,3S)-1-iodo-2,4-dimethylpentan-3-yl] propanoate Traditional Name: propionic acid [(1S,2S)-3-iodo-1-isopropyl-2-methyl-propyl] ester Formula: C10H19IO2 MolecularWeight: 298.16113

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C(C)C)C(C)CI

Isomeric SMILES

CCC(=O)O[C@H]([C@H](C)CI)C(C)C

InChI

InChI=1S/C10H19IO2/c1-5-9(12)13-10(7(2)3)8(4)6-11/h7-8,10H,5-6H2,1-4H3/t8-,10+/m1/s1