3-(4-acetamido-3-nitro-phenyl)propanoic acid

Systemtic Name: 3-(4-acetamido-3-nitro-phenyl)propanoic acid Openeye Name: 3-(4-acetamido-3-nitro-phenyl)propanoic acid CAS Name: 3-(4-acetamido-3-nitrophenyl)propanoic acid IUPAC Name: 3-(4-acetamido-3-nitrophenyl)propanoic acid Traditional Name: 3-(4-acetamido-3-nitro-phenyl)propionic acid Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)CCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)CCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H12N2O5/c1-7(14)12-9-4-2-8(3-5-11(15)16)6-10(9)13(17)18/h2,4,6H,3,5H2,1H3,(H,12,14)(H,15,16)