[(2S,6S)-6-oxidanyldodec-7-yn-2-yl] methanoate

Systemtic Name: [(2S,6S)-6-oxidanyldodec-7-yn-2-yl] methanoate Openeye Name: [(1S,5S)-5-hydroxy-1-methyl-undec-6-ynyl] formate CAS Name: formic acid [(2S,6S)-6-hydroxydodec-7-yn-2-yl] ester IUPAC Name: [(2S,6S)-6-hydroxydodec-7-yn-2-yl] formate Traditional Name: formic acid [(1S,5S)-5-hydroxy-1-methyl-undec-6-ynyl] ester Formula: C13H19O3 MolecularWeight: 223.28816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC([CH][CH][CH]C(C)OC=O)O

Isomeric SMILES

CCCCC#C[C@H]([CH][CH][CH][C@H](C)OC=O)O

InChI

InChI=1S/C13H19O3/c1-3-4-5-6-9-13(15)10-7-8-12(2)16-11-14/h7-8,10-13,15H,3-5H2,1-2H3/t12-,13+/m0/s1