(E)-3-[3-nitro-4-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]phenyl]prop-2-enoate

Systemtic Name: (E)-3-[3-nitro-4-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]phenyl]prop-2-enoate Openeye Name: (E)-3-[3-nitro-4-[(E)-3-oxido-3-oxo-prop-1-enyl]phenyl]prop-2-enoate CAS Name: (E)-3-[3-nitro-4-[(E)-3-oxido-3-oxoprop-1-enyl]phenyl]-2-propenoate IUPAC Name: (E)-3-[3-nitro-4-[(E)-3-oxido-3-oxoprop-1-enyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(E)-3-keto-3-oxido-prop-1-enyl]-3-nitro-phenyl]acrylate Formula: C12H7NO6-2 MolecularWeight: 261.18708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)[O-])[N+](=O)[O-])C=CC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H9NO6/c14-11(15)5-2-8-1-3-9(4-6-12(16)17)10(7-8)13(18)19/h1-7H,(H,14,15)(H,16,17)/p-2/b5-2+,6-4+