2-azanylbutanedioic acid; 2,4-dinitrophenol

Systemtic Name: 2-azanylbutanedioic acid; 2,4-dinitrophenol Openeye Name: 2-aminobutanedioic acid; 2,4-dinitrophenol CAS Name: 2-aminobutanedioic acid; 2,4-dinitrophenol IUPAC Name: 2-aminobutanedioic acid; 2,4-dinitrophenol Traditional Name: 2-aminosuccinic acid; 2,4-dinitrophenol Formula: C10H11N3O9 MolecularWeight: 317.20904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H4N2O5.C4H7NO4/c9-6-2-1-4(7(10)11)3-5(6)8(12)13;5-2(4(8)9)1-3(6)7/h1-3,9H;2H,1,5H2,(H,6,7)(H,8,9)