1-(5-dodec-1-ynylthiophen-2-yl)-2-(methylamino)propane-1,3-diol

Systemtic Name: 1-(5-dodec-1-ynylthiophen-2-yl)-2-(methylamino)propane-1,3-diol Openeye Name: 1-(5-dodec-1-ynyl-2-thienyl)-2-(methylamino)propane-1,3-diol CAS Name: 1-(5-dodec-1-ynyl-2-thiophenyl)-2-(methylamino)propane-1,3-diol IUPAC Name: 1-(5-dodec-1-ynylthiophen-2-yl)-2-(methylamino)propane-1,3-diol Traditional Name: 1-(5-dodec-1-ynyl-2-thienyl)-2-(methylamino)propane-1,3-diol Formula: C20H33NO2S MolecularWeight: 351.54652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC1=CC=C(S1)C(C(CO)NC)O

Isomeric SMILES

CCCCCCCCCCC#CC1=CC=C(S1)C(C(CO)NC)O

InChI

InChI=1S/C20H33NO2S/c1-3-4-5-6-7-8-9-10-11-12-13-17-14-15-19(24-17)20(23)18(16-22)21-2/h14-15,18,20-23H,3-11,16H2,1-2H3