tert-butyl N-[(2S,3R,4S)-1-cyano-4-methyl-2-oxidanyl-hexan-3-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3R,4S)-1-cyano-4-methyl-2-oxidanyl-hexan-3-yl]carbamate Openeye Name: tert-butyl N-[(1R,2S)-1-[(1S)-2-cyano-1-hydroxy-ethyl]-2-methyl-butyl]carbamate CAS Name: N-[(2S,3R,4S)-1-cyano-2-hydroxy-4-methylhexan-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R,4S)-1-cyano-2-hydroxy-4-methylhexan-3-yl]carbamate Traditional Name: N-[(1R,2S)-1-[(1S)-2-cyano-1-hydroxy-ethyl]-2-methyl-butyl]carbamic acid tert-butyl ester Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(CC#N)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@H](C)[C@H]([C@H](CC#N)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C13H24N2O3/c1-6-9(2)11(10(16)7-8-14)15-12(17)18-13(3,4)5/h9-11,16H,6-7H2,1-5H3,(H,15,17)/t9-,10-,11+/m0/s1