tert-butyl N-[(2S,3R)-1,3-bis(oxidanyl)dodec-4-yn-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3R)-1,3-bis(oxidanyl)dodec-4-yn-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-2-hydroxy-1-(hydroxymethyl)undec-3-ynyl]carbamate CAS Name: N-[(2S,3R)-1,3-dihydroxydodec-4-yn-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R)-1,3-dihydroxydodec-4-yn-2-yl]carbamate Traditional Name: N-[(1S,2R)-2-hydroxy-1-methylol-undec-3-ynyl]carbamic acid tert-butyl ester Formula: C17H31NO4 MolecularWeight: 313.43234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC#CC(C(CO)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CCCCCCCC#C[C@H]([C@H](CO)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C17H31NO4/c1-5-6-7-8-9-10-11-12-15(20)14(13-19)18-16(21)22-17(2,3)4/h14-15,19-20H,5-10,13H2,1-4H3,(H,18,21)/t14-,15+/m0/s1