ethyl (E)-6-(2-methylprop-2-enylsulfanyl)non-2-en-4-ynoate

Systemtic Name: ethyl (E)-6-(2-methylprop-2-enylsulfanyl)non-2-en-4-ynoate Openeye Name: ethyl (E)-6-(2-methylallylsulfanyl)non-2-en-4-ynoate CAS Name: (E)-6-(2-methylprop-2-enylthio)non-2-en-4-ynoic acid ethyl ester IUPAC Name: ethyl (E)-6-(2-methylprop-2-enylsulfanyl)non-2-en-4-ynoate Traditional Name: (E)-6-(2-methylallylthio)non-2-en-4-ynoic acid ethyl ester Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#CC=CC(=O)OCC)SCC(=C)C

Isomeric SMILES

CCCC(C#C/C=C/C(=O)OCC)SCC(=C)C

InChI

InChI=1S/C15H22O2S/c1-5-9-14(18-12-13(3)4)10-7-8-11-15(16)17-6-2/h8,11,14H,3,5-6,9,12H2,1-2,4H3/b11-8+