methyl (2S,3S)-2-acetamido-5-methyl-3-oxidanyl-2-propyl-hexanoate

Systemtic Name: methyl (2S,3S)-2-acetamido-5-methyl-3-oxidanyl-2-propyl-hexanoate Openeye Name: methyl (2S,3S)-2-acetamido-3-hydroxy-5-methyl-2-propyl-hexanoate CAS Name: (2S,3S)-2-acetamido-3-hydroxy-5-methyl-2-propylhexanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2-acetamido-3-hydroxy-5-methyl-2-propylhexanoate Traditional Name: (2S,3S)-2-acetamido-3-hydroxy-5-methyl-2-propyl-hexanoic acid methyl ester Formula: C13H25NO4 MolecularWeight: 259.3419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)O)(C(=O)OC)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C13H25NO4/c1-6-7-13(12(17)18-5,14-10(4)15)11(16)8-9(2)3/h9,11,16H,6-8H2,1-5H3,(H,14,15)/t11-,13-/m0/s1