3-[(2,4-dinitrophenyl)amino]propanoic acid

Systemtic Name: 3-[(2,4-dinitrophenyl)amino]propanoic acid Openeye Name: 3-(2,4-dinitroanilino)propanoic acid CAS Name: 3-(2,4-dinitroanilino)propanoic acid IUPAC Name: 3-(2,4-dinitroanilino)propanoic acid Traditional Name: 3-(2,4-dinitroanilino)propionic acid Formula: C9H9N3O6 MolecularWeight: 255.18426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9N3O6/c13-9(14)3-4-10-7-2-1-6(11(15)16)5-8(7)12(17)18/h1-2,5,10H,3-4H2,(H,13,14)