ethyl (2S)-2-(2-acetamido-4-nitro-phenoxy)propanoate

Systemtic Name: ethyl (2S)-2-(2-acetamido-4-nitro-phenoxy)propanoate Openeye Name: ethyl (2S)-2-(2-acetamido-4-nitro-phenoxy)propanoate CAS Name: (2S)-2-(2-acetamido-4-nitrophenoxy)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(2-acetamido-4-nitrophenoxy)propanoate Traditional Name: (2S)-2-(2-acetamido-4-nitro-phenoxy)propionic acid ethyl ester Formula: C13H16N2O6 MolecularWeight: 296.27594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CCOC(=O)[C@H](C)OC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C13H16N2O6/c1-4-20-13(17)8(2)21-12-6-5-10(15(18)19)7-11(12)14-9(3)16/h5-8H,4H2,1-3H3,(H,14,16)/t8-/m0/s1