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

Systemtic Name: 3-[(2,4-dinitrophenyl)amino]butanoic acid Openeye Name: 3-(2,4-dinitroanilino)butanoic acid CAS Name: 3-(2,4-dinitroanilino)butanoic acid IUPAC Name: 3-(2,4-dinitroanilino)butanoic acid Traditional Name: 3-(2,4-dinitroanilino)butyric acid Formula: C10H11N3O6 MolecularWeight: 269.21084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N3O6/c1-6(4-10(14)15)11-8-3-2-7(12(16)17)5-9(8)13(18)19/h2-3,5-6,11H,4H2,1H3,(H,14,15)