2-(2,4-dinitrophenyl)pentanoic acid

Systemtic Name: 2-(2,4-dinitrophenyl)pentanoic acid Openeye Name: 2-(2,4-dinitrophenyl)pentanoic acid CAS Name: 2-(2,4-dinitrophenyl)pentanoic acid IUPAC Name: 2-(2,4-dinitrophenyl)pentanoic acid Traditional Name: 2-(2,4-dinitrophenyl)valeric acid Formula: C11H12N2O6 MolecularWeight: 268.22278

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCCC(C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H12N2O6/c1-2-3-9(11(14)15)8-5-4-7(12(16)17)6-10(8)13(18)19/h4-6,9H,2-3H2,1H3,(H,14,15)