methyl (2S)-2-[1-(4-nitrophenyl)ethylamino]propanoate

Systemtic Name: methyl (2S)-2-[1-(4-nitrophenyl)ethylamino]propanoate Openeye Name: methyl (2S)-2-[1-(4-nitrophenyl)ethylamino]propanoate CAS Name: (2S)-2-[1-(4-nitrophenyl)ethylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[1-(4-nitrophenyl)ethylamino]propanoate Traditional Name: (2S)-2-[1-(4-nitrophenyl)ethylamino]propionic acid methyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)[N+](=O)[O-])NC(C)C(=O)OC

Isomeric SMILES

C[C@@H](C(=O)OC)NC(C)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O4/c1-8(13-9(2)12(15)18-3)10-4-6-11(7-5-10)14(16)17/h4-9,13H,1-3H3/t8?,9-/m0/s1