(phenylmethyl) 3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl-(3-oxidanylidene-3-phenylmethoxy-propyl)amino]propanoate

Systemtic Name: (phenylmethyl) 3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl-(3-oxidanylidene-3-phenylmethoxy-propyl)amino]propanoate Openeye Name: benzyl 3-[(3-benzyloxy-3-oxo-propyl)-[2-(tert-butoxycarbonylamino)-1-methyl-ethyl]amino]propanoate CAS Name: 3-[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propan-2-yl-(3-oxo-3-phenylmethoxypropyl)amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl-(3-oxo-3-phenylmethoxypropyl)amino]propanoate Traditional Name: 3-[(3-benzoxy-3-keto-propyl)-[2-(tert-butoxycarbonylamino)-1-methyl-ethyl]amino]propionic acid benzyl ester Formula: C28H38N2O6 MolecularWeight: 498.61112

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)OC(C)(C)C)N(CCC(=O)OCC1=CC=CC=C1)CCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(CNC(=O)OC(C)(C)C)N(CCC(=O)OCC1=CC=CC=C1)CCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C28H38N2O6/c1-22(19-29-27(33)36-28(2,3)4)30(17-15-25(31)34-20-23-11-7-5-8-12-23)18-16-26(32)35-21-24-13-9-6-10-14-24/h5-14,22H,15-21H2,1-4H3,(H,29,33)