(6E)-6-(3-bromanyl-1H-pyridin-2-ylidene)-3,5-dinitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-(3-bromanyl-1H-pyridin-2-ylidene)-3,5-dinitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-(3-bromo-1H-pyridin-2-ylidene)-3,5-dinitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-(3-bromo-1H-pyridin-2-ylidene)-3,5-dinitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(3-bromo-1H-pyridin-2-ylidene)-3,5-dinitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-(3-bromo-1H-pyridin-2-ylidene)-3,5-dinitro-cyclohexa-2,4-dien-1-one Formula: C11H6BrN3O5 MolecularWeight: 340.08644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C2C(=CC(=CC2=O)[N+](=O)[O-])[N+](=O)[O-])C(=C1)Br

Isomeric SMILES

C1=CN/C(=C/2\C(=CC(=CC2=O)[N+](=O)[O-])[N+](=O)[O-])/C(=C1)Br

InChI

InChI=1S/C11H6BrN3O5/c12-7-2-1-3-13-11(7)10-8(15(19)20)4-6(14(17)18)5-9(10)16/h1-5,13H/b11-10+