methyl (2S)-6-azanyl-2-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonyl-amino]hexanoate

Systemtic Name: methyl (2S)-6-azanyl-2-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonyl-amino]hexanoate Openeye Name: methyl (2S)-6-amino-2-[benzyloxycarbonyl(tert-butoxycarbonyl)amino]hexanoate CAS Name: (2S)-6-amino-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-phenylmethoxycarbonylamino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-6-amino-2-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonylamino]hexanoate Traditional Name: (2S)-6-amino-2-[tert-butoxycarbonyl(carbobenzoxy)amino]hexanoic acid methyl ester Formula: C20H30N2O6 MolecularWeight: 394.462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C(CCCCN)C(=O)OC)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)N([C@@H](CCCCN)C(=O)OC)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C20H30N2O6/c1-20(2,3)28-19(25)22(16(17(23)26-4)12-8-9-13-21)18(24)27-14-15-10-6-5-7-11-15/h5-7,10-11,16H,8-9,12-14,21H2,1-4H3/t16-/m0/s1