methyl 9,12-bis(oxidanyl)dodec-10-ynoate

Systemtic Name: methyl 9,12-bis(oxidanyl)dodec-10-ynoate Openeye Name: methyl 9,12-dihydroxydodec-10-ynoate CAS Name: 9,12-dihydroxy-10-dodecynoic acid methyl ester IUPAC Name: methyl 9,12-dihydroxydodec-10-ynoate Traditional Name: 9,12-dihydroxydodec-10-ynoic acid methyl ester Formula: C13H22O4 MolecularWeight: 242.31138

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCC(C#CCO)O

Isomeric SMILES

COC(=O)CCCCCCCC(C#CCO)O

InChI

InChI=1S/C13H22O4/c1-17-13(16)10-6-4-2-3-5-8-12(15)9-7-11-14/h12,14-15H,2-6,8,10-11H2,1H3