dodec-9-ynyl 2-thiophen-2-ylethanoate

Systemtic Name: dodec-9-ynyl 2-thiophen-2-ylethanoate Openeye Name: dodec-9-ynyl 2-(2-thienyl)acetate CAS Name: 2-thiophen-2-ylacetic acid dodec-9-ynyl ester IUPAC Name: dodec-9-ynyl 2-thiophen-2-ylacetate Traditional Name: 2-(2-thienyl)acetic acid dodec-9-ynyl ester Formula: C18H26O2S MolecularWeight: 306.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCCCCCCCCOC(=O)CC1=CC=CS1

Isomeric SMILES

CCC#CCCCCCCCCOC(=O)CC1=CC=CS1

InChI

InChI=1S/C18H26O2S/c1-2-3-4-5-6-7-8-9-10-11-14-20-18(19)16-17-13-12-15-21-17/h12-13,15H,2,5-11,14,16H2,1H3