tert-butyl N-[(2S)-1-cyano-5-(dimethylamino)-1-oxidanyl-5-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-cyano-5-(dimethylamino)-1-oxidanyl-5-oxidanylidene-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[cyano(hydroxy)methyl]-4-(dimethylamino)-4-oxo-butyl]carbamate CAS Name: N-[(2S)-1-cyano-5-(dimethylamino)-1-hydroxy-5-oxopentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-cyano-5-(dimethylamino)-1-hydroxy-5-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[cyano(hydroxy)methyl]-4-(dimethylamino)-4-keto-butyl]carbamic acid tert-butyl ester Formula: C13H23N3O4 MolecularWeight: 285.33942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23N3O4/c1-13(2,3)20-12(19)15-9(10(17)8-14)6-7-11(18)16(4)5/h9-10,17H,6-7H2,1-5H3,(H,15,19)/t9-,10?/m0/s1