methyl (2S)-2-acetamido-3-(3-nitrophenyl)propanoate

Systemtic Name: methyl (2S)-2-acetamido-3-(3-nitrophenyl)propanoate Openeye Name: methyl (2S)-2-acetamido-3-(3-nitrophenyl)propanoate CAS Name: (2S)-2-acetamido-3-(3-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-acetamido-3-(3-nitrophenyl)propanoate Traditional Name: (2S)-2-acetamido-3-(3-nitrophenyl)propionic acid methyl ester Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C12H14N2O5/c1-8(15)13-11(12(16)19-2)7-9-4-3-5-10(6-9)14(17)18/h3-6,11H,7H2,1-2H3,(H,13,15)/t11-/m0/s1