(5S)-2-methyl-5-pyridin-4-yl-hex-3-yne-2,5-diol

Systemtic Name: (5S)-2-methyl-5-pyridin-4-yl-hex-3-yne-2,5-diol Openeye Name: (5S)-2-methyl-5-(4-pyridyl)hex-3-yne-2,5-diol CAS Name: (5S)-2-methyl-5-pyridin-4-yl-3-hexyne-2,5-diol IUPAC Name: (5S)-2-methyl-5-pyridin-4-ylhex-3-yne-2,5-diol Traditional Name: (5S)-2-methyl-5-(4-pyridyl)hex-3-yne-2,5-diol Formula: C12H15NO2 MolecularWeight: 205.253

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC(C)(C1=CC=NC=C1)O)O

Isomeric SMILES

C[C@@](C#CC(C)(C)O)(C1=CC=NC=C1)O

InChI

InChI=1S/C12H15NO2/c1-11(2,14)6-7-12(3,15)10-4-8-13-9-5-10/h4-5,8-9,14-15H,1-3H3/t12-/m1/s1