(E)-3-(4-methoxy-2,6-dinitro-3-oxidanyl-phenyl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(4-methoxy-2,6-dinitro-3-oxidanyl-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(3-hydroxy-4-methoxy-2,6-dinitro-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-(3-hydroxy-4-methoxy-2,6-dinitrophenyl)-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(3-hydroxy-4-methoxy-2,6-dinitrophenyl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-(3-hydroxy-4-methoxy-2,6-dinitro-phenyl)-1-phenyl-prop-2-en-1-one Formula: C16H12N2O7 MolecularWeight: 344.27568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)[N+](=O)[O-])C=CC(=O)C2=CC=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C(=C(C(=C1)[N+](=O)[O-])/C=C/C(=O)C2=CC=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C16H12N2O7/c1-25-14-9-12(17(21)22)11(15(16(14)20)18(23)24)7-8-13(19)10-5-3-2-4-6-10/h2-9,20H,1H3/b8-7+