[(2S)-1-[[(3R)-3-azanyl-4-cyclohexyl-2-oxidanyl-butanoyl]amino]propan-2-yl] propanoate

Systemtic Name: [(2S)-1-[[(3R)-3-azanyl-4-cyclohexyl-2-oxidanyl-butanoyl]amino]propan-2-yl] propanoate Openeye Name: [(1S)-2-[[(3R)-3-amino-4-cyclohexyl-2-hydroxy-butanoyl]amino]-1-methyl-ethyl] propanoate CAS Name: propanoic acid [(2S)-1-[[(3R)-3-amino-4-cyclohexyl-2-hydroxy-1-oxobutyl]amino]propan-2-yl] ester IUPAC Name: [(2S)-1-[[(3R)-3-amino-4-cyclohexyl-2-hydroxybutanoyl]amino]propan-2-yl] propanoate Traditional Name: propionic acid [(1S)-2-[[(3R)-3-amino-4-cyclohexyl-2-hydroxy-butanoyl]amino]-1-methyl-ethyl] ester Formula: C16H30N2O4 MolecularWeight: 314.4204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C)CNC(=O)C(C(CC1CCCCC1)N)O

Isomeric SMILES

CCC(=O)O[C@@H](C)CNC(=O)C([C@@H](CC1CCCCC1)N)O

InChI

InChI=1S/C16H30N2O4/c1-3-14(19)22-11(2)10-18-16(21)15(20)13(17)9-12-7-5-4-6-8-12/h11-13,15,20H,3-10,17H2,1-2H3,(H,18,21)/t11-,13+,15?/m0/s1