2-oxidanylidene-3-[2-(phenylmethoxycarbonylamino)ethanoylamino]propanoic acid

Systemtic Name: 2-oxidanylidene-3-[2-(phenylmethoxycarbonylamino)ethanoylamino]propanoic acid Openeye Name: 3-[[2-(benzyloxycarbonylamino)acetyl]amino]-2-oxo-propanoic acid CAS Name: 2-oxo-3-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]propanoic acid IUPAC Name: 2-oxo-3-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoic acid Traditional Name: 3-[[2-(benzyloxycarbonylamino)acetyl]amino]-2-keto-propionic acid Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC(=O)NCC(=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC(=O)NCC(=O)C(=O)O

InChI

InChI=1S/C13H14N2O6/c16-10(12(18)19)6-14-11(17)7-15-13(20)21-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,14,17)(H,15,20)(H,18,19)