tert-butyl N-[(2S,3S)-1,3-bis(oxidanyl)-5-phenyl-pent-4-yn-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3S)-1,3-bis(oxidanyl)-5-phenyl-pent-4-yn-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2S)-2-hydroxy-1-(hydroxymethyl)-4-phenyl-but-3-ynyl]carbamate CAS Name: N-[(2S,3S)-1,3-dihydroxy-5-phenylpent-4-yn-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3S)-1,3-dihydroxy-5-phenylpent-4-yn-2-yl]carbamate Traditional Name: N-[(1S,2S)-2-hydroxy-1-methylol-4-phenyl-but-3-ynyl]carbamic acid tert-butyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CO)C(C#CC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CO)[C@H](C#CC1=CC=CC=C1)O

InChI

InChI=1S/C16H21NO4/c1-16(2,3)21-15(20)17-13(11-18)14(19)10-9-12-7-5-4-6-8-12/h4-8,13-14,18-19H,11H2,1-3H3,(H,17,20)/t13-,14-/m0/s1