methyl 2-azido-3-(4-dodec-1-ynylthiophen-2-yl)-3-oxidanyl-propanoate

Systemtic Name: methyl 2-azido-3-(4-dodec-1-ynylthiophen-2-yl)-3-oxidanyl-propanoate Openeye Name: methyl 2-azido-3-(4-dodec-1-ynyl-2-thienyl)-3-hydroxy-propanoate CAS Name: 2-azido-3-(4-dodec-1-ynyl-2-thiophenyl)-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-azido-3-(4-dodec-1-ynylthiophen-2-yl)-3-hydroxypropanoate Traditional Name: 2-azido-3-(4-dodec-1-ynyl-2-thienyl)-3-hydroxy-propionic acid methyl ester Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC1=CSC(=C1)C(C(C(=O)OC)N=[N+]=[N-])O

Isomeric SMILES

CCCCCCCCCCC#CC1=CSC(=C1)C(C(C(=O)OC)N=[N+]=[N-])O

InChI

InChI=1S/C20H29N3O3S/c1-3-4-5-6-7-8-9-10-11-12-13-16-14-17(27-15-16)19(24)18(22-23-21)20(25)26-2/h14-15,18-19,24H,3-11H2,1-2H3