methyl (2S)-2-[(1R)-1-oxidanylprop-2-ynyl]hexanoate

Systemtic Name: methyl (2S)-2-[(1R)-1-oxidanylprop-2-ynyl]hexanoate Openeye Name: methyl (2S)-2-[(1R)-1-hydroxyprop-2-ynyl]hexanoate CAS Name: (2S)-2-[(1R)-1-hydroxyprop-2-ynyl]hexanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1R)-1-hydroxyprop-2-ynyl]hexanoate Traditional Name: (2S,3R)-2-butyl-3-hydroxy-pent-4-ynoic acid methyl ester Formula: C10H16O3 MolecularWeight: 184.23224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C#C)O)C(=O)OC

Isomeric SMILES

CCCC[C@@H]([C@H](C#C)O)C(=O)OC

InChI

InChI=1S/C10H16O3/c1-4-6-7-8(9(11)5-2)10(12)13-3/h2,8-9,11H,4,6-7H2,1,3H3/t8-,9-/m0/s1