methyl 7-oxidanyldodec-2-ynoate

Systemtic Name: methyl 7-oxidanyldodec-2-ynoate Openeye Name: methyl 7-hydroxydodec-2-ynoate CAS Name: 7-hydroxy-2-dodecynoic acid methyl ester IUPAC Name: methyl 7-hydroxydodec-2-ynoate Traditional Name: 7-hydroxydodec-2-ynoic acid methyl ester Formula: C13H22O3 MolecularWeight: 226.31198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC#CC(=O)OC)O

Isomeric SMILES

CCCCCC(CCCC#CC(=O)OC)O

InChI

InChI=1S/C13H22O3/c1-3-4-6-9-12(14)10-7-5-8-11-13(15)16-2/h12,14H,3-7,9-10H2,1-2H3