(E)-3-(2,4-dinitrophenyl)-4-ethoxy-4-oxidanyl-but-3-en-2-one

Systemtic Name: (E)-3-(2,4-dinitrophenyl)-4-ethoxy-4-oxidanyl-but-3-en-2-one Openeye Name: (E)-3-(2,4-dinitrophenyl)-4-ethoxy-4-hydroxy-but-3-en-2-one CAS Name: (E)-3-(2,4-dinitrophenyl)-4-ethoxy-4-hydroxy-3-buten-2-one IUPAC Name: (E)-3-(2,4-dinitrophenyl)-4-ethoxy-4-hydroxybut-3-en-2-one Traditional Name: (E)-3-(2,4-dinitrophenyl)-4-ethoxy-4-hydroxy-but-3-en-2-one Formula: C12H12N2O7 MolecularWeight: 296.23288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCO/C(=C(\C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C(=O)C)/O

InChI

InChI=1S/C12H12N2O7/c1-3-21-12(16)11(7(2)15)9-5-4-8(13(17)18)6-10(9)14(19)20/h4-6,16H,3H2,1-2H3/b12-11-