6-[(2,4-dinitrophenyl)amino]hexanoic acid

Systemtic Name: 6-[(2,4-dinitrophenyl)amino]hexanoic acid Openeye Name: 6-(2,4-dinitroanilino)hexanoic acid CAS Name: 6-(2,4-dinitroanilino)hexanoic acid IUPAC Name: 6-(2,4-dinitroanilino)hexanoic acid Traditional Name: 6-(2,4-dinitroanilino)hexanoic acid Formula: C12H15N3O6 MolecularWeight: 297.264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O6/c16-12(17)4-2-1-3-7-13-10-6-5-9(14(18)19)8-11(10)15(20)21/h5-6,8,13H,1-4,7H2,(H,16,17)