3-(2,4-dinitrophenoxy)-3-oxidanyl-2-phenyl-butanoic acid

Systemtic Name: 3-(2,4-dinitrophenoxy)-3-oxidanyl-2-phenyl-butanoic acid Openeye Name: 3-(2,4-dinitrophenoxy)-3-hydroxy-2-phenyl-butanoic acid CAS Name: 3-(2,4-dinitrophenoxy)-3-hydroxy-2-phenylbutanoic acid IUPAC Name: 3-(2,4-dinitrophenoxy)-3-hydroxy-2-phenylbutanoic acid Traditional Name: 3-(2,4-dinitrophenoxy)-3-hydroxy-2-phenyl-butyric acid Formula: C16H14N2O8 MolecularWeight: 362.29096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)C(=O)O)(O)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C(C1=CC=CC=C1)C(=O)O)(O)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O8/c1-16(21,14(15(19)20)10-5-3-2-4-6-10)26-13-8-7-11(17(22)23)9-12(13)18(24)25/h2-9,14,21H,1H3,(H,19,20)