(2S)-2-acetamido-4-(4-nitrophenyl)butanoic acid

Systemtic Name: (2S)-2-acetamido-4-(4-nitrophenyl)butanoic acid Openeye Name: (2S)-2-acetamido-4-(4-nitrophenyl)butanoic acid CAS Name: (2S)-2-acetamido-4-(4-nitrophenyl)butanoic acid IUPAC Name: (2S)-2-acetamido-4-(4-nitrophenyl)butanoic acid Traditional Name: (2S)-2-acetamido-4-(4-nitrophenyl)butyric acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(=O)N[C@@H](CCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H14N2O5/c1-8(15)13-11(12(16)17)7-4-9-2-5-10(6-3-9)14(18)19/h2-3,5-6,11H,4,7H2,1H3,(H,13,15)(H,16,17)/t11-/m0/s1