methyl (2S)-2-(hexanoylamino)-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-(hexanoylamino)-3-methyl-butanoate Openeye Name: methyl (2S)-2-(hexanoylamino)-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-(1-oxohexylamino)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-(hexanoylamino)-3-methylbutanoate Traditional Name: (2S)-2-(caproylamino)-3-methyl-butyric acid methyl ester Formula: C12H23NO3 MolecularWeight: 229.31592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(C(C)C)C(=O)OC

Isomeric SMILES

CCCCCC(=O)N[C@@H](C(C)C)C(=O)OC

InChI

InChI=1S/C12H23NO3/c1-5-6-7-8-10(14)13-11(9(2)3)12(15)16-4/h9,11H,5-8H2,1-4H3,(H,13,14)/t11-/m0/s1