(E)-3-(3,4-dimethoxy-2,6-dinitro-phenyl)-1-pyridin-2-yl-prop-2-en-1-one

Systemtic Name: (E)-3-(3,4-dimethoxy-2,6-dinitro-phenyl)-1-pyridin-2-yl-prop-2-en-1-one Openeye Name: (E)-3-(3,4-dimethoxy-2,6-dinitro-phenyl)-1-(2-pyridyl)prop-2-en-1-one CAS Name: (E)-3-(3,4-dimethoxy-2,6-dinitrophenyl)-1-(2-pyridinyl)-2-propen-1-one IUPAC Name: (E)-3-(3,4-dimethoxy-2,6-dinitrophenyl)-1-pyridin-2-ylprop-2-en-1-one Traditional Name: (E)-3-(3,4-dimethoxy-2,6-dinitro-phenyl)-1-(2-pyridyl)prop-2-en-1-one Formula: C16H13N3O7 MolecularWeight: 359.29032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)[N+](=O)[O-])C=CC(=O)C2=CC=CC=N2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)[N+](=O)[O-])/C=C/C(=O)C2=CC=CC=N2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H13N3O7/c1-25-14-9-12(18(21)22)10(15(19(23)24)16(14)26-2)6-7-13(20)11-5-3-4-8-17-11/h3-9H,1-2H3/b7-6+