(E)-2-ethyl-12-methoxy-2-methylsulfanyl-dodec-4-enoic acid

Systemtic Name: (E)-2-ethyl-12-methoxy-2-methylsulfanyl-dodec-4-enoic acid Openeye Name: (E)-2-ethyl-12-methoxy-2-methylsulfanyl-dodec-4-enoic acid CAS Name: (E)-2-ethyl-12-methoxy-2-(methylthio)-4-dodecenoic acid IUPAC Name: (E)-2-ethyl-12-methoxy-2-methylsulfanyldodec-4-enoic acid Traditional Name: (E)-2-ethyl-12-methoxy-2-(methylthio)dodec-4-enoic acid Formula: C16H30O3S MolecularWeight: 302.4726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC=CCCCCCCCOC)(C(=O)O)SC

Isomeric SMILES

CCC(C/C=C/CCCCCCCOC)(C(=O)O)SC

InChI

InChI=1S/C16H30O3S/c1-4-16(20-3,15(17)18)13-11-9-7-5-6-8-10-12-14-19-2/h9,11H,4-8,10,12-14H2,1-3H3,(H,17,18)/b11-9+