(phenylmethyl) 3-[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]ethanoylamino]propanoate

Systemtic Name: (phenylmethyl) 3-[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]ethanoylamino]propanoate Openeye Name: benzyl 3-[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]acetyl]amino]propanoate CAS Name: 3-[[1-oxo-2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]ethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetyl]amino]propanoate Traditional Name: 3-[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]acetyl]amino]propionic acid benzyl ester Formula: C22H25N3O6 MolecularWeight: 427.4504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCNC(=O)CNC(=O)CNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCNC(=O)CNC(=O)CNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H25N3O6/c26-19(23-12-11-21(28)30-15-17-7-3-1-4-8-17)13-24-20(27)14-25-22(29)31-16-18-9-5-2-6-10-18/h1-10H,11-16H2,(H,23,26)(H,24,27)(H,25,29)