2-bromanyl-6-methoxy-4-[(E)-2-nitrobut-1-enyl]phenolate

Systemtic Name: 2-bromanyl-6-methoxy-4-[(E)-2-nitrobut-1-enyl]phenolate Openeye Name: 2-bromo-6-methoxy-4-[(E)-2-nitrobut-1-enyl]phenolate CAS Name: 2-bromo-6-methoxy-4-[(E)-2-nitrobut-1-enyl]phenolate IUPAC Name: 2-bromo-6-methoxy-4-[(E)-2-nitrobut-1-enyl]phenolate Traditional Name: 2-bromo-6-methoxy-4-[(E)-2-nitrobut-1-enyl]phenolate Formula: C11H11BrNO4- MolecularWeight: 301.11334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=CC(=C(C(=C1)Br)[O-])OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C11H12BrNO4/c1-3-8(13(15)16)4-7-5-9(12)11(14)10(6-7)17-2/h4-6,14H,3H2,1-2H3/p-1/b8-4+