tert-butyl N-[(2S)-1-(cyanomethylamino)-1-oxidanylidene-hexan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-(cyanomethylamino)-1-oxidanylidene-hexan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(cyanomethylcarbamoyl)pentyl]carbamate CAS Name: N-[(2S)-1-(cyanomethylamino)-1-oxohexan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(cyanomethylamino)-1-oxohexan-2-yl]carbamate Traditional Name: N-[(1S)-1-(cyanomethylcarbamoyl)pentyl]carbamic acid tert-butyl ester Formula: C13H23N3O3 MolecularWeight: 269.34002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NCC#N)NC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C13H23N3O3/c1-5-6-7-10(11(17)15-9-8-14)16-12(18)19-13(2,3)4/h10H,5-7,9H2,1-4H3,(H,15,17)(H,16,18)/t10-/m0/s1