tert-butyl 2-[[2-(hydroxymethyl)-3-phenyl-propanoyl]amino]hexanoate

Systemtic Name: tert-butyl 2-[[2-(hydroxymethyl)-3-phenyl-propanoyl]amino]hexanoate Openeye Name: tert-butyl 2-[(2-benzyl-3-hydroxy-propanoyl)amino]hexanoate CAS Name: 2-[[2-(hydroxymethyl)-1-oxo-3-phenylpropyl]amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2-benzyl-3-hydroxypropanoyl)amino]hexanoate Traditional Name: 2-[(2-benzyl-3-hydroxy-propanoyl)amino]hexanoic acid tert-butyl ester Formula: C20H31NO4 MolecularWeight: 349.46444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC(C)(C)C)NC(=O)C(CC1=CC=CC=C1)CO

Isomeric SMILES

CCCCC(C(=O)OC(C)(C)C)NC(=O)C(CC1=CC=CC=C1)CO

InChI

InChI=1S/C20H31NO4/c1-5-6-12-17(19(24)25-20(2,3)4)21-18(23)16(14-22)13-15-10-8-7-9-11-15/h7-11,16-17,22H,5-6,12-14H2,1-4H3,(H,21,23)