(E)-1-(5-chloranyl-2,4-dinitro-phenyl)-3-ethoxy-3-oxidanyl-prop-2-en-1-one

Systemtic Name: (E)-1-(5-chloranyl-2,4-dinitro-phenyl)-3-ethoxy-3-oxidanyl-prop-2-en-1-one Openeye Name: (E)-1-(5-chloro-2,4-dinitro-phenyl)-3-ethoxy-3-hydroxy-prop-2-en-1-one CAS Name: (E)-1-(5-chloro-2,4-dinitrophenyl)-3-ethoxy-3-hydroxy-2-propen-1-one IUPAC Name: (E)-1-(5-chloro-2,4-dinitrophenyl)-3-ethoxy-3-hydroxyprop-2-en-1-one Traditional Name: (E)-1-(5-chloro-2,4-dinitro-phenyl)-3-ethoxy-3-hydroxy-prop-2-en-1-one Formula: C11H9ClN2O7 MolecularWeight: 316.65136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9ClN2O7/c1-2-21-11(16)5-10(15)6-3-7(12)9(14(19)20)4-8(6)13(17)18/h3-5,16H,2H2,1H3/b11-5+