(4-nitrophenyl)methyl (2S)-2-(2-phenoxyethanoylamino)propanoate

Systemtic Name: (4-nitrophenyl)methyl (2S)-2-(2-phenoxyethanoylamino)propanoate Openeye Name: (4-nitrophenyl)methyl (2S)-2-[(2-phenoxyacetyl)amino]propanoate CAS Name: (2S)-2-[(1-oxo-2-phenoxyethyl)amino]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2S)-2-[(2-phenoxyacetyl)amino]propanoate Traditional Name: (2S)-2-[(2-phenoxyacetyl)amino]propionic acid (4-nitrobenzyl) ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)COC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O6/c1-13(19-17(21)12-25-16-5-3-2-4-6-16)18(22)26-11-14-7-9-15(10-8-14)20(23)24/h2-10,13H,11-12H2,1H3,(H,19,21)/t13-/m0/s1