(phenylmethyl) (2S)-6-azanyl-2-[phenylmethoxycarbonyl-(phenylmethyl)amino]hexanoate

Systemtic Name: (phenylmethyl) (2S)-6-azanyl-2-[phenylmethoxycarbonyl-(phenylmethyl)amino]hexanoate Openeye Name: benzyl (2S)-6-amino-2-[benzyl(benzyloxycarbonyl)amino]hexanoate CAS Name: (2S)-6-amino-2-[phenylmethoxycarbonyl-(phenylmethyl)amino]hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-6-amino-2-[benzyl(phenylmethoxycarbonyl)amino]hexanoate Traditional Name: (2S)-6-amino-2-[benzyl(carbobenzoxy)amino]hexanoic acid benzyl ester Formula: C28H32N2O4 MolecularWeight: 460.56468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C(CCCCN)C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN([C@@H](CCCCN)C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H32N2O4/c29-19-11-10-18-26(27(31)33-21-24-14-6-2-7-15-24)30(20-23-12-4-1-5-13-23)28(32)34-22-25-16-8-3-9-17-25/h1-9,12-17,26H,10-11,18-22,29H2/t26-/m0/s1